1-(2-methylphenyl)-N-(3-oxidanylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: 1-(2-methylphenyl)-N-(3-oxidanylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: N-(3-hydroxypropyl)-1-(o-tolyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: N-(3-hydroxypropyl)-1-(2-methylphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: N-(3-hydroxypropyl)-1-(2-methylphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: N-(3-hydroxypropyl)-1-(o-tolyl)-9H-$b-carboline-3-carboxamide Formula: C22H21N3O2 MolecularWeight: 359.42104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C3C(=CC(=N2)C(=O)NCCCO)C4=CC=CC=C4N3

Isomeric SMILES

CC1=CC=CC=C1C2=C3C(=CC(=N2)C(=O)NCCCO)C4=CC=CC=C4N3

InChI

InChI=1S/C22H21N3O2/c1-14-7-2-3-8-15(14)20-21-17(16-9-4-5-10-18(16)24-21)13-19(25-20)22(27)23-11-6-12-26/h2-5,7-10,13,24,26H,6,11-12H2,1H3,(H,23,27)