[4-[(E)-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)hydrazinylidene]methyl]phenyl] 3-nitrobenzoate

Systemtic Name: [4-[(E)-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)hydrazinylidene]methyl]phenyl] 3-nitrobenzoate Openeye Name: [4-[(E)-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)hydrazono]methyl]phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[(E)-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)hydrazinylidene]methyl]phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-[(E)-[(4-keto-6-methyl-1H-pyrimidin-2-yl)hydrazono]methyl]phenyl] ester Formula: C19H15N5O5 MolecularWeight: 393.3529

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)NN=CC2=CC=C(C=C2)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)N=C(N1)N/N=C/C2=CC=C(C=C2)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H15N5O5/c1-12-9-17(25)22-19(21-12)23-20-11-13-5-7-16(8-6-13)29-18(26)14-3-2-4-15(10-14)24(27)28/h2-11H,1H3,(H2,21,22,23,25)/b20-11+