ethyl 1-[1-[(5-chloranyl-1-methyl-indol-3-yl)methyl]piperidin-4-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-[(5-chloranyl-1-methyl-indol-3-yl)methyl]piperidin-4-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[1-[(5-chloro-1-methyl-indol-3-yl)methyl]piperidine-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[1-[(5-chloro-1-methyl-3-indolyl)methyl]-4-piperidinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-[(5-chloro-1-methylindol-3-yl)methyl]piperidine-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[1-[(5-chloro-1-methyl-indol-3-yl)methyl]isonipecotoyl]nipecotic acid ethyl ester Formula: C24H32ClN3O3 MolecularWeight: 445.98218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2CCN(CC2)CC3=CN(C4=C3C=C(C=C4)Cl)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2CCN(CC2)CC3=CN(C4=C3C=C(C=C4)Cl)C

InChI

InChI=1S/C24H32ClN3O3/c1-3-31-24(30)18-5-4-10-28(16-18)23(29)17-8-11-27(12-9-17)15-19-14-26(2)22-7-6-20(25)13-21(19)22/h6-7,13-14,17-18H,3-5,8-12,15-16H2,1-2H3