9-butyl-N-[1-(2-fluorophenyl)-3-methyl-2-oxidanylidene-indol-3-yl]pyrido[3,4-b]indole-3-carboxamide hydrochloride

Systemtic Name: 9-butyl-N-[1-(2-fluorophenyl)-3-methyl-2-oxidanylidene-indol-3-yl]pyrido[3,4-b]indole-3-carboxamide hydrochloride Openeye Name: 9-butyl-N-[1-(2-fluorophenyl)-3-methyl-2-oxo-indolin-3-yl]pyrido[3,4-b]indole-3-carboxamide hydrochloride CAS Name: 9-butyl-N-[1-(2-fluorophenyl)-3-methyl-2-oxo-3-indolyl]-3-pyrido[3,4-b]indolecarboxamide hydrochloride IUPAC Name: 9-butyl-N-[1-(2-fluorophenyl)-3-methyl-2-oxoindol-3-yl]pyrido[3,4-b]indole-3-carboxamide hydrochloride Traditional Name: 9-butyl-N-[1-(2-fluorophenyl)-2-keto-3-methyl-indolin-3-yl]-$b-carboline-3-carboxamide hydrochloride Formula: C31H28ClFN4O2 MolecularWeight: 543.031023

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2C3=CC(=NC=C31)C(=O)NC4(C5=CC=CC=C5N(C4=O)C6=CC=CC=C6F)C.Cl

Isomeric SMILES

CCCCN1C2=CC=CC=C2C3=CC(=NC=C31)C(=O)NC4(C5=CC=CC=C5N(C4=O)C6=CC=CC=C6F)C.Cl

InChI

InChI=1S/C31H27FN4O2.ClH/c1-3-4-17-35-25-14-8-5-11-20(25)21-18-24(33-19-28(21)35)29(37)34-31(2)22-12-6-9-15-26(22)36(30(31)38)27-16-10-7-13-23(27)32;/h5-16,18-19H,3-4,17H2,1-2H3,(H,34,37);1H