2-[(3-methoxy-4-phenylmethoxy-phenyl)methyl-methyl-amino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[(3-methoxy-4-phenylmethoxy-phenyl)methyl-methyl-amino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[(4-benzyloxy-3-methoxy-phenyl)methyl-methyl-amino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[(3-methoxy-4-phenylmethoxyphenyl)methyl-methylamino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[(3-methoxy-4-phenylmethoxyphenyl)methyl-methylamino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[(4-benzoxy-3-methoxy-benzyl)-methyl-amino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C24H23N4O5+ MolecularWeight: 447.46322

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)C3=C(C(=O)[N+]4=CC=CC=C4N3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)C3=C(C(=O)[N+]4=CC=CC=C4N3)[N+](=O)[O-]

InChI

InChI=1S/C24H22N4O5/c1-26(23-22(28(30)31)24(29)27-13-7-6-10-21(27)25-23)15-18-11-12-19(20(14-18)32-2)33-16-17-8-4-3-5-9-17/h3-14H,15-16H2,1-2H3/p+1