2-[[(4-chloranyl-3-nitro-phenyl)amino]methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[[(4-chloranyl-3-nitro-phenyl)amino]methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[(4-chloro-3-nitro-anilino)methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[(4-chloro-3-nitroanilino)methyl]-7-methyl-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[(4-chloro-3-nitroanilino)methyl]-7-methylpyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[(4-chloro-3-nitro-anilino)methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Formula: C16H13ClN4O3 MolecularWeight: 344.75242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)CNC3=CC(=C(C=C3)Cl)[N+](=O)[O-])C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)CNC3=CC(=C(C=C3)Cl)[N+](=O)[O-])C=C1

InChI

InChI=1S/C16H13ClN4O3/c1-10-2-5-15-19-12(7-16(22)20(15)9-10)8-18-11-3-4-13(17)14(6-11)21(23)24/h2-7,9,18H,8H2,1H3