4-[2-[4-[(4-chlorophenyl)-quinolin-8-yl-methyl]-2-propan-2-yl-piperazin-1-yl]-2-oxidanylidene-ethyl]piperidine-1-carboxamide

Systemtic Name: 4-[2-[4-[(4-chlorophenyl)-quinolin-8-yl-methyl]-2-propan-2-yl-piperazin-1-yl]-2-oxidanylidene-ethyl]piperidine-1-carboxamide Openeye Name: 4-[2-[4-[(4-chlorophenyl)-(8-quinolyl)methyl]-2-isopropyl-piperazin-1-yl]-2-oxo-ethyl]piperidine-1-carboxamide CAS Name: 4-[2-[4-[(4-chlorophenyl)-(8-quinolinyl)methyl]-2-propan-2-yl-1-piperazinyl]-2-oxoethyl]-1-piperidinecarboxamide IUPAC Name: 4-[2-[4-[(4-chlorophenyl)-quinolin-8-ylmethyl]-2-propan-2-ylpiperazin-1-yl]-2-oxoethyl]piperidine-1-carboxamide Traditional Name: 4-[2-[4-[(4-chlorophenyl)-(8-quinolyl)methyl]-2-isopropyl-piperazino]-2-keto-ethyl]piperidine-1-carboxamide Formula: C31H38ClN5O2 MolecularWeight: 548.11872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CN(CCN1C(=O)CC2CCN(CC2)C(=O)N)C(C3=CC=C(C=C3)Cl)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CC(C)C1CN(CCN1C(=O)CC2CCN(CC2)C(=O)N)C(C3=CC=C(C=C3)Cl)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C31H38ClN5O2/c1-21(2)27-20-36(17-18-37(27)28(38)19-22-12-15-35(16-13-22)31(33)39)30(24-8-10-25(32)11-9-24)26-7-3-5-23-6-4-14-34-29(23)26/h3-11,14,21-22,27,30H,12-13,15-20H2,1-2H3,(H2,33,39)