4-(5-chloranyl-2-pyridin-2-yl-1H-indol-3-yl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]butan-1-one

Systemtic Name: 4-(5-chloranyl-2-pyridin-2-yl-1H-indol-3-yl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]butan-1-one Openeye Name: 4-[5-chloro-2-(2-pyridyl)-1H-indol-3-yl]-1-[4-(4-methoxyphenyl)piperazin-1-yl]butan-1-one CAS Name: 4-[5-chloro-2-(2-pyridinyl)-1H-indol-3-yl]-1-[4-(4-methoxyphenyl)-1-piperazinyl]-1-butanone IUPAC Name: 4-(5-chloro-2-pyridin-2-yl-1H-indol-3-yl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]butan-1-one Traditional Name: 4-[5-chloro-2-(2-pyridyl)-1H-indol-3-yl]-1-[4-(4-methoxyphenyl)piperazino]butan-1-one Formula: C28H29ClN4O2 MolecularWeight: 489.00846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCCC3=C(NC4=C3C=C(C=C4)Cl)C5=CC=CC=N5

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CCCC3=C(NC4=C3C=C(C=C4)Cl)C5=CC=CC=N5

InChI

InChI=1S/C28H29ClN4O2/c1-35-22-11-9-21(10-12-22)32-15-17-33(18-16-32)27(34)7-4-5-23-24-19-20(29)8-13-25(24)31-28(23)26-6-2-3-14-30-26/h2-3,6,8-14,19,31H,4-5,7,15-18H2,1H3