N-[2-[(2R,4S)-4-butyl-1-(phenylmethyl)pyrrolidin-2-yl]ethyl]-5-chloranyl-2-methoxy-4-(methylamino)benzamide

Systemtic Name: N-[2-[(2R,4S)-4-butyl-1-(phenylmethyl)pyrrolidin-2-yl]ethyl]-5-chloranyl-2-methoxy-4-(methylamino)benzamide Openeye Name: N-[2-[(2R,4S)-1-benzyl-4-butyl-pyrrolidin-2-yl]ethyl]-5-chloro-2-methoxy-4-(methylamino)benzamide CAS Name: N-[2-[(2R,4S)-4-butyl-1-(phenylmethyl)-2-pyrrolidinyl]ethyl]-5-chloro-2-methoxy-4-(methylamino)benzamide IUPAC Name: N-[2-[(2R,4S)-1-benzyl-4-butylpyrrolidin-2-yl]ethyl]-5-chloro-2-methoxy-4-(methylamino)benzamide Traditional Name: N-[2-[(2R,4S)-1-benzyl-4-butyl-pyrrolidin-2-yl]ethyl]-5-chloro-2-methoxy-4-(methylamino)benzamide Formula: C26H36ClN3O2 MolecularWeight: 458.03594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC(N(C1)CC2=CC=CC=C2)CCNC(=O)C3=CC(=C(C=C3OC)NC)Cl

Isomeric SMILES

CCCC[C@H]1C[C@@H](N(C1)CC2=CC=CC=C2)CCNC(=O)C3=CC(=C(C=C3OC)NC)Cl

InChI

InChI=1S/C26H36ClN3O2/c1-4-5-9-20-14-21(30(18-20)17-19-10-7-6-8-11-19)12-13-29-26(31)22-15-23(27)24(28-2)16-25(22)32-3/h6-8,10-11,15-16,20-21,28H,4-5,9,12-14,17-18H2,1-3H3,(H,29,31)/t20-,21-/m0/s1