8-chloranyl-4-oxidanylidene-3-[(Z)-(4-prop-2-enoxyphenyl)methylideneamino]-5H-pyrimido[5,4-b]indol-2-olate

Systemtic Name: 8-chloranyl-4-oxidanylidene-3-[(Z)-(4-prop-2-enoxyphenyl)methylideneamino]-5H-pyrimido[5,4-b]indol-2-olate Openeye Name: 3-[(Z)-(4-allyloxyphenyl)methyleneamino]-8-chloro-4-oxo-5H-pyrimido[5,4-b]indol-2-olate CAS Name: 8-chloro-4-oxo-3-[(Z)-(4-prop-2-enoxyphenyl)methylideneamino]-5H-pyrimido[5,4-b]indol-2-olate IUPAC Name: 8-chloro-4-oxo-3-[(Z)-(4-prop-2-enoxyphenyl)methylideneamino]-5H-pyrimido[5,4-b]indol-2-olate Traditional Name: 3-[(Z)-(4-allyloxybenzylidene)amino]-8-chloro-4-keto-5H-pyrimid[5,4-b]indol-2-olate Formula: C20H14ClN4O3- MolecularWeight: 393.80316

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=C(C=C1)C=NN2C(=O)C3=C(C4=C(N3)C=CC(=C4)Cl)N=C2[O-]

Isomeric SMILES

C=CCOC1=CC=C(C=C1)/C=N\N2C(=O)C3=C(C4=C(N3)C=CC(=C4)Cl)N=C2[O-]

InChI

InChI=1S/C20H15ClN4O3/c1-2-9-28-14-6-3-12(4-7-14)11-22-25-19(26)18-17(24-20(25)27)15-10-13(21)5-8-16(15)23-18/h2-8,10-11,23H,1,9H2,(H,24,27)/p-1/b22-11-