1-(3-bromophenyl)-N-(3-oxidanylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: 1-(3-bromophenyl)-N-(3-oxidanylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: 1-(3-bromophenyl)-N-(3-hydroxypropyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: 1-(3-bromophenyl)-N-(3-hydroxypropyl)-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: 1-(3-bromophenyl)-N-(3-hydroxypropyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: 1-(3-bromophenyl)-N-(3-hydroxypropyl)-9H-$b-carboline-3-carboxamide Formula: C21H18BrN3O2 MolecularWeight: 424.29052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=CC(=NC(=C3N2)C4=CC(=CC=C4)Br)C(=O)NCCCO

Isomeric SMILES

C1=CC=C2C(=C1)C3=CC(=NC(=C3N2)C4=CC(=CC=C4)Br)C(=O)NCCCO

InChI

InChI=1S/C21H18BrN3O2/c22-14-6-3-5-13(11-14)19-20-16(15-7-1-2-8-17(15)24-20)12-18(25-19)21(27)23-9-4-10-26/h1-3,5-8,11-12,24,26H,4,9-10H2,(H,23,27)