3-(3,4-dimethylphenyl)-8-methoxy-4-oxidanylidene-5H-pyrimido[5,4-b]indol-2-olate

Systemtic Name: 3-(3,4-dimethylphenyl)-8-methoxy-4-oxidanylidene-5H-pyrimido[5,4-b]indol-2-olate Openeye Name: 3-(3,4-dimethylphenyl)-8-methoxy-4-oxo-5H-pyrimido[5,4-b]indol-2-olate CAS Name: 3-(3,4-dimethylphenyl)-8-methoxy-4-oxo-5H-pyrimido[5,4-b]indol-2-olate IUPAC Name: 3-(3,4-dimethylphenyl)-8-methoxy-4-oxo-5H-pyrimido[5,4-b]indol-2-olate Traditional Name: 3-(3,4-dimethylphenyl)-4-keto-8-methoxy-5H-pyrimid[5,4-b]indol-2-olate Formula: C19H16N3O3- MolecularWeight: 334.34864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=C(C4=C(N3)C=CC(=C4)OC)N=C2[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=C(C4=C(N3)C=CC(=C4)OC)N=C2[O-])C

InChI

InChI=1S/C19H17N3O3/c1-10-4-5-12(8-11(10)2)22-18(23)17-16(21-19(22)24)14-9-13(25-3)6-7-15(14)20-17/h4-9,20H,1-3H3,(H,21,24)/p-1