ethyl 1-[1-[(2-aminocarbonyl-5-chloranyl-1H-indol-3-yl)sulfonyl]piperidin-4-yl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-[(2-aminocarbonyl-5-chloranyl-1H-indol-3-yl)sulfonyl]piperidin-4-yl]piperidine-3-carboxylate Openeye Name: ethyl 1-[1-[(2-carbamoyl-5-chloro-1H-indol-3-yl)sulfonyl]-4-piperidyl]piperidine-3-carboxylate CAS Name: 1-[1-[(2-carbamoyl-5-chloro-1H-indol-3-yl)sulfonyl]-4-piperidinyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-[(2-carbamoyl-5-chloro-1H-indol-3-yl)sulfonyl]piperidin-4-yl]piperidine-3-carboxylate Traditional Name: 1-[1-[(2-carbamoyl-5-chloro-1H-indol-3-yl)sulfonyl]-4-piperidyl]nipecotic acid ethyl ester Formula: C22H29ClN4O5S MolecularWeight: 497.00746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2CCN(CC2)S(=O)(=O)C3=C(NC4=C3C=C(C=C4)Cl)C(=O)N

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C2CCN(CC2)S(=O)(=O)C3=C(NC4=C3C=C(C=C4)Cl)C(=O)N

InChI

InChI=1S/C22H29ClN4O5S/c1-2-32-22(29)14-4-3-9-26(13-14)16-7-10-27(11-8-16)33(30,31)20-17-12-15(23)5-6-18(17)25-19(20)21(24)28/h5-6,12,14,16,25H,2-4,7-11,13H2,1H3,(H2,24,28)