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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CCCC2=C(NC3=C2C=C(C=C3)Cl)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CC1CCCCN1C(=O)CCCC2=C(NC3=C2C=C(C=C3)Cl)C4=NC5=CC=CC=C5C=C4

InChI

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