4-(5-chloranyl-2-quinolin-2-yl-1H-indol-3-yl)-1-(4-methylpiperidin-1-yl)butan-1-one

Systemtic Name: 4-(5-chloranyl-2-quinolin-2-yl-1H-indol-3-yl)-1-(4-methylpiperidin-1-yl)butan-1-one Openeye Name: 4-[5-chloro-2-(2-quinolyl)-1H-indol-3-yl]-1-(4-methyl-1-piperidyl)butan-1-one CAS Name: 4-[5-chloro-2-(2-quinolinyl)-1H-indol-3-yl]-1-(4-methyl-1-piperidinyl)-1-butanone IUPAC Name: 4-(5-chloro-2-quinolin-2-yl-1H-indol-3-yl)-1-(4-methylpiperidin-1-yl)butan-1-one Traditional Name: 4-[5-chloro-2-(2-quinolyl)-1H-indol-3-yl]-1-(4-methylpiperidino)butan-1-one Formula: C27H28ClN3O MolecularWeight: 445.98372

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CCCC2=C(NC3=C2C=C(C=C3)Cl)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CC1CCN(CC1)C(=O)CCCC2=C(NC3=C2C=C(C=C3)Cl)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H28ClN3O/c1-18-13-15-31(16-14-18)26(32)8-4-6-21-22-17-20(28)10-12-24(22)30-27(21)25-11-9-19-5-2-3-7-23(19)29-25/h2-3,5,7,9-12,17-18,30H,4,6,8,13-16H2,1H3