ethanoic acid; 2-methyl-5-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-9H-pyrido[3,4-b]indol-1-one

Systemtic Name: ethanoic acid; 2-methyl-5-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-9H-pyrido[3,4-b]indol-1-one Openeye Name: acetic acid; 5-[2-hydroxy-3-(isopropylamino)propoxy]-2-methyl-9H-pyrido[3,4-b]indol-1-one CAS Name: acetic acid; 5-[2-hydroxy-3-(propan-2-ylamino)propoxy]-2-methyl-9H-pyrido[3,4-b]indol-1-one IUPAC Name: acetic acid; 5-[2-hydroxy-3-(propan-2-ylamino)propoxy]-2-methyl-9H-pyrido[3,4-b]indol-1-one Traditional Name: acetic acid; 5-[2-hydroxy-3-(isopropylamino)propoxy]-2-methyl-9H-$b-carbolin-1-one Formula: C20H27N3O5 MolecularWeight: 389.44548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=CC=CC2=C1C3=C(N2)C(=O)N(C=C3)C)O.CC(=O)O

Isomeric SMILES

CC(C)NCC(COC1=CC=CC2=C1C3=C(N2)C(=O)N(C=C3)C)O.CC(=O)O

InChI

InChI=1S/C18H23N3O3.C2H4O2/c1-11(2)19-9-12(22)10-24-15-6-4-5-14-16(15)13-7-8-21(3)18(23)17(13)20-14;1-2(3)4/h4-8,11-12,19-20,22H,9-10H2,1-3H3;1H3,(H,3,4)