2-[[(Z)-(3-methyl-1-naphthalen-1-yl-5-oxidanylidene-pyrazol-4-ylidene)methyl]amino]-4-nitro-phenolate

Systemtic Name: 2-[[(Z)-(3-methyl-1-naphthalen-1-yl-5-oxidanylidene-pyrazol-4-ylidene)methyl]amino]-4-nitro-phenolate Openeye Name: 2-[[(Z)-[3-methyl-1-(1-naphthyl)-5-oxo-pyrazol-4-ylidene]methyl]amino]-4-nitro-phenolate CAS Name: 2-[[(Z)-[3-methyl-1-(1-naphthalenyl)-5-oxo-4-pyrazolylidene]methyl]amino]-4-nitrophenolate IUPAC Name: 2-[[(Z)-(3-methyl-1-naphthalen-1-yl-5-oxopyrazol-4-ylidene)methyl]amino]-4-nitrophenolate Traditional Name: 2-[[(Z)-[5-keto-3-methyl-1-(1-naphthyl)-2-pyrazolin-4-ylidene]methyl]amino]-4-nitro-phenolate Formula: C21H15N4O4- MolecularWeight: 387.3682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNC2=C(C=CC(=C2)[N+](=O)[O-])[O-])C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\NC2=C(C=CC(=C2)[N+](=O)[O-])[O-])C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H16N4O4/c1-13-17(12-22-18-11-15(25(28)29)9-10-20(18)26)21(27)24(23-13)19-8-4-6-14-5-2-3-7-16(14)19/h2-12,22,26H,1H3/p-1/b17-12-