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

Systemtic Name: 1-(4-methoxyphenyl)-N-(3-oxidanylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: N-(3-hydroxypropyl)-1-(4-methoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: N-(3-hydroxypropyl)-1-(4-methoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: N-(3-hydroxypropyl)-1-(4-methoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: N-(3-hydroxypropyl)-1-(4-methoxyphenyl)-9H-$b-carboline-3-carboxamide Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C3C(=CC(=N2)C(=O)NCCCO)C4=CC=CC=C4N3

Isomeric SMILES

COC1=CC=C(C=C1)C2=C3C(=CC(=N2)C(=O)NCCCO)C4=CC=CC=C4N3

InChI

InChI=1S/C22H21N3O3/c1-28-15-9-7-14(8-10-15)20-21-17(16-5-2-3-6-18(16)24-21)13-19(25-20)22(27)23-11-4-12-26/h2-3,5-10,13,24,26H,4,11-12H2,1H3,(H,23,27)