methyl 3-[(2-cyanophenyl)methylamino]-4-oxidanylidene-pyrido[1,2-a]pyrimidine-7-carboxylate

Systemtic Name: methyl 3-[(2-cyanophenyl)methylamino]-4-oxidanylidene-pyrido[1,2-a]pyrimidine-7-carboxylate Openeye Name: methyl 3-[(2-cyanophenyl)methylamino]-4-oxo-pyrido[1,2-a]pyrimidine-7-carboxylate CAS Name: 3-[(2-cyanophenyl)methylamino]-4-oxo-7-pyrido[1,2-a]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-cyanophenyl)methylamino]-4-oxopyrido[1,2-a]pyrimidine-7-carboxylate Traditional Name: 3-[(2-cyanobenzyl)amino]-4-keto-pyrido[1,2-a]pyrimidine-7-carboxylic acid methyl ester Formula: C18H14N4O3 MolecularWeight: 334.32876

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN2C(=NC=C(C2=O)NCC3=CC=CC=C3C#N)C=C1

Isomeric SMILES

COC(=O)C1=CN2C(=NC=C(C2=O)NCC3=CC=CC=C3C#N)C=C1

InChI

InChI=1S/C18H14N4O3/c1-25-18(24)14-6-7-16-21-10-15(17(23)22(16)11-14)20-9-13-5-3-2-4-12(13)8-19/h2-7,10-11,20H,9H2,1H3