3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-8-methyl-2H-pyridazino[4,5-b]indol-4-one

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-8-methyl-2H-pyridazino[4,5-b]indol-4-one Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-8-methyl-2H-pyridazino[4,5-b]indol-4-one CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-8-methyl-2H-pyridazino[4,5-b]indol-4-one IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-8-methyl-2H-pyridazino[4,5-b]indol-4-one Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-8-methyl-2H-pyridazin[4,5-b]indol-4-one Formula: C19H22N4O2 MolecularWeight: 338.40358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C3C2=CNN(C3=O)CC(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C3C2=CNN(C3=O)CC(=O)N4CCCCCC4

InChI

InChI=1S/C19H22N4O2/c1-13-6-7-16-14(10-13)15-11-20-23(19(25)18(15)21-16)12-17(24)22-8-4-2-3-5-9-22/h6-7,10-11,20H,2-5,8-9,12H2,1H3