dimethyl 1-(3-chloranyl-4-methyl-phenyl)-2-oxidanylidene-11bH-pyrimido[2,1-a]isoquinoline-3,4-dicarboxylate

Systemtic Name: dimethyl 1-(3-chloranyl-4-methyl-phenyl)-2-oxidanylidene-11bH-pyrimido[2,1-a]isoquinoline-3,4-dicarboxylate Openeye Name: dimethyl 1-(3-chloro-4-methyl-phenyl)-2-oxo-11bH-pyrimido[2,1-a]isoquinoline-3,4-dicarboxylate CAS Name: 1-(3-chloro-4-methylphenyl)-2-oxo-11bH-pyrimido[2,1-a]isoquinoline-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(3-chloro-4-methylphenyl)-2-oxo-11bH-pyrimido[2,1-a]isoquinoline-3,4-dicarboxylate Traditional Name: 1-(3-chloro-4-methyl-phenyl)-2-keto-11bH-pyrimid[2,1-a]isoquinoline-3,4-dicarboxylic acid dimethyl ester Formula: C23H19ClN2O5 MolecularWeight: 438.86036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C3C4=CC=CC=C4C=CN3C(=C(C2=O)C(=O)OC)C(=O)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3C4=CC=CC=C4C=CN3C(=C(C2=O)C(=O)OC)C(=O)OC)Cl

InChI

InChI=1S/C23H19ClN2O5/c1-13-8-9-15(12-17(13)24)26-20-16-7-5-4-6-14(16)10-11-25(20)19(23(29)31-3)18(21(26)27)22(28)30-2/h4-12,20H,1-3H3