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

Systemtic Name: 4-(5-chloranyl-2-quinolin-2-yl-1H-indol-3-yl)-1-(4-phenylpiperazin-1-yl)butan-1-one Openeye Name: 4-[5-chloro-2-(2-quinolyl)-1H-indol-3-yl]-1-(4-phenylpiperazin-1-yl)butan-1-one CAS Name: 4-[5-chloro-2-(2-quinolinyl)-1H-indol-3-yl]-1-(4-phenyl-1-piperazinyl)-1-butanone IUPAC Name: 4-(5-chloro-2-quinolin-2-yl-1H-indol-3-yl)-1-(4-phenylpiperazin-1-yl)butan-1-one Traditional Name: 4-[5-chloro-2-(2-quinolyl)-1H-indol-3-yl]-1-(4-phenylpiperazino)butan-1-one Formula: C31H29ClN4O MolecularWeight: 509.04116

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CCCC3=C(NC4=C3C=C(C=C4)Cl)C5=NC6=CC=CC=C6C=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CCCC3=C(NC4=C3C=C(C=C4)Cl)C5=NC6=CC=CC=C6C=C5

InChI

InChI=1S/C31H29ClN4O/c32-23-14-16-28-26(21-23)25(31(34-28)29-15-13-22-7-4-5-11-27(22)33-29)10-6-12-30(37)36-19-17-35(18-20-36)24-8-2-1-3-9-24/h1-5,7-9,11,13-16,21,34H,6,10,12,17-20H2