3-[(E)-(4-decoxyphenyl)methylideneamino]-8-methoxy-2-methyl-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-[(E)-(4-decoxyphenyl)methylideneamino]-8-methoxy-2-methyl-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-[(E)-(4-decoxyphenyl)methyleneamino]-8-methoxy-2-methyl-5H-pyrimido[5,4-b]indol-4-one CAS Name: 3-[(E)-(4-decoxyphenyl)methylideneamino]-8-methoxy-2-methyl-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-[(E)-(4-decoxyphenyl)methylideneamino]-8-methoxy-2-methyl-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-[(E)-(4-decoxybenzylidene)amino]-8-methoxy-2-methyl-5H-pyrimid[5,4-b]indol-4-one Formula: C29H36N4O3 MolecularWeight: 488.62114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C=NN2C(=NC3=C(C2=O)NC4=C3C=C(C=C4)OC)C

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)/C=N/N2C(=NC3=C(C2=O)NC4=C3C=C(C=C4)OC)C

InChI

InChI=1S/C29H36N4O3/c1-4-5-6-7-8-9-10-11-18-36-23-14-12-22(13-15-23)20-30-33-21(2)31-27-25-19-24(35-3)16-17-26(25)32-28(27)29(33)34/h12-17,19-20,32H,4-11,18H2,1-3H3/b30-20+