2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-3-nitro-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-3-nitro-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-3-nitro-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[4-[(3-chlorophenyl)methyl]-1-piperazinyl]-3-nitro-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-3-nitropyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[4-(3-chlorobenzyl)piperazino]-3-nitro-pyrido[1,2-a]pyrimidin-4-one Formula: C19H18ClN5O3 MolecularWeight: 399.83092

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)Cl)C3=C(C(=O)N4C=CC=CC4=N3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)Cl)C3=C(C(=O)N4C=CC=CC4=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H18ClN5O3/c20-15-5-3-4-14(12-15)13-22-8-10-23(11-9-22)18-17(25(27)28)19(26)24-7-2-1-6-16(24)21-18/h1-7,12H,8-11,13H2