6-(4-methoxyphenyl)-2-[(3-nitrophenyl)amino]-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(4-methoxyphenyl)-2-[(3-nitrophenyl)amino]-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(4-methoxyphenyl)-2-(3-nitroanilino)-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-(4-methoxyphenyl)-2-(3-nitroanilino)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(4-methoxyphenyl)-2-(3-nitroanilino)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 4-keto-6-(4-methoxyphenyl)-2-(3-nitroanilino)-1H-pyrimidine-5-carbonitrile Formula: C18H13N5O4 MolecularWeight: 363.32692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=O)N=C(N2)NC3=CC(=CC=C3)[N+](=O)[O-])C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=O)N=C(N2)NC3=CC(=CC=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C18H13N5O4/c1-27-14-7-5-11(6-8-14)16-15(10-19)17(24)22-18(21-16)20-12-3-2-4-13(9-12)23(25)26/h2-9H,1H3,(H2,20,21,22,24)