6-[(3R)-3-[2,6-bis(chloranyl)-4-methyl-phenoxy]pyrrolidin-1-yl]-N-[1-[2-chloranyl-5-(cyclopropylcarbamoyl)phenyl]ethyl]-N-cyclopropyl-3-pyridin-4-yl-piperidine-3-carboxamide

Systemtic Name: 6-[(3R)-3-[2,6-bis(chloranyl)-4-methyl-phenoxy]pyrrolidin-1-yl]-N-[1-[2-chloranyl-5-(cyclopropylcarbamoyl)phenyl]ethyl]-N-cyclopropyl-3-pyridin-4-yl-piperidine-3-carboxamide Openeye Name: N-[1-[2-chloro-5-(cyclopropylcarbamoyl)phenyl]ethyl]-N-cyclopropyl-6-[(3R)-3-(2,6-dichloro-4-methyl-phenoxy)pyrrolidin-1-yl]-3-(4-pyridyl)piperidine-3-carboxamide CAS Name: N-[1-[2-chloro-5-[(cyclopropylamino)-oxomethyl]phenyl]ethyl]-N-cyclopropyl-6-[(3R)-3-(2,6-dichloro-4-methylphenoxy)-1-pyrrolidinyl]-3-pyridin-4-yl-3-piperidinecarboxamide IUPAC Name: N-[1-[2-chloro-5-(cyclopropylcarbamoyl)phenyl]ethyl]-N-cyclopropyl-6-[(3R)-3-(2,6-dichloro-4-methylphenoxy)pyrrolidin-1-yl]-3-pyridin-4-ylpiperidine-3-carboxamide Traditional Name: N-[1-[2-chloro-5-(cyclopropylcarbamoyl)phenyl]ethyl]-N-cyclopropyl-6-[(3R)-3-(2,6-dichloro-4-methyl-phenoxy)pyrrolidino]-3-(4-pyridyl)nipecotamide Formula: C37H42Cl3N5O3 MolecularWeight: 711.12008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)OC2CCN(C2)C3CCC(CN3)(C4=CC=NC=C4)C(=O)N(C5CC5)C(C)C6=C(C=CC(=C6)C(=O)NC7CC7)Cl)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)O[C@@H]2CCN(C2)C3CCC(CN3)(C4=CC=NC=C4)C(=O)N(C5CC5)C(C)C6=C(C=CC(=C6)C(=O)NC7CC7)Cl)Cl

InChI

InChI=1S/C37H42Cl3N5O3/c1-22-17-31(39)34(32(40)18-22)48-28-12-16-44(20-28)33-9-13-37(21-42-33,25-10-14-41-15-11-25)36(47)45(27-6-7-27)23(2)29-19-24(3-8-30(29)38)35(46)43-26-4-5-26/h3,8,10-11,14-15,17-19,23,26-28,33,42H,4-7,9,12-13,16,20-21H2,1-2H3,(H,43,46)/t23?,28-,33?,37?/m1/s1