4-[[1-[(2,4-dinitrophenyl)amino]-5-(4-methoxyphenyl)-2-oxidanylidene-pyrrol-3-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[[1-[(2,4-dinitrophenyl)amino]-5-(4-methoxyphenyl)-2-oxidanylidene-pyrrol-3-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[1-(2,4-dinitroanilino)-5-(4-methoxyphenyl)-2-oxo-pyrrol-3-ylidene]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[1-(2,4-dinitroanilino)-5-(4-methoxyphenyl)-2-oxo-3-pyrrolylidene]amino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[1-(2,4-dinitroanilino)-5-(4-methoxyphenyl)-2-oxopyrrol-3-ylidene]amino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[[1-(2,4-dinitroanilino)-2-keto-5-(4-methoxyphenyl)-2-pyrrolin-3-ylidene]amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C28H23N7O7 MolecularWeight: 569.52492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=C3C=C(N(C3=O)NC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=C3C=C(N(C3=O)NC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])C5=CC=C(C=C5)OC

InChI

InChI=1S/C28H23N7O7/c1-17-26(28(37)33(31(17)2)19-7-5-4-6-8-19)29-23-16-24(18-9-12-21(42-3)13-10-18)32(27(23)36)30-22-14-11-20(34(38)39)15-25(22)35(40)41/h4-16,30H,1-3H3