3-[(E)-(4-chlorophenyl)methylideneamino]-7-methoxy-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-[(E)-(4-chlorophenyl)methylideneamino]-7-methoxy-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-[(E)-(4-chlorophenyl)methyleneamino]-7-methoxy-5H-pyrimido[5,4-b]indol-4-one CAS Name: 3-[(E)-(4-chlorophenyl)methylideneamino]-7-methoxy-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-[(E)-(4-chlorophenyl)methylideneamino]-7-methoxy-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-[(E)-(4-chlorobenzylidene)amino]-7-methoxy-5H-pyrimid[5,4-b]indol-4-one Formula: C18H13ClN4O2 MolecularWeight: 352.77442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(N2)C(=O)N(C=N3)N=CC4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(N2)C(=O)N(C=N3)/N=C/C4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H13ClN4O2/c1-25-13-6-7-14-15(8-13)22-17-16(14)20-10-23(18(17)24)21-9-11-2-4-12(19)5-3-11/h2-10,22H,1H3/b21-9+