3-[2,5-dimethyl-3-[(E)-[(5-nitropyridin-2-yl)hydrazinylidene]methyl]pyrrol-1-yl]-2-methyl-benzoate

Systemtic Name: 3-[2,5-dimethyl-3-[(E)-[(5-nitropyridin-2-yl)hydrazinylidene]methyl]pyrrol-1-yl]-2-methyl-benzoate Openeye Name: 3-[2,5-dimethyl-3-[(E)-[(5-nitro-2-pyridyl)hydrazono]methyl]pyrrol-1-yl]-2-methyl-benzoate CAS Name: 3-[2,5-dimethyl-3-[(E)-[(5-nitro-2-pyridinyl)hydrazinylidene]methyl]-1-pyrrolyl]-2-methylbenzoate IUPAC Name: 3-[2,5-dimethyl-3-[(E)-[(5-nitropyridin-2-yl)hydrazinylidene]methyl]pyrrol-1-yl]-2-methylbenzoate Traditional Name: 3-[2,5-dimethyl-3-[(E)-[(5-nitro-2-pyridyl)hydrazono]methyl]pyrrol-1-yl]-2-methyl-benzoate Formula: C20H18N5O4- MolecularWeight: 392.38802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC(=C2C)C(=O)[O-])C)C=NNC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC(=C2C)C(=O)[O-])C)/C=N/NC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O4/c1-12-9-15(10-22-23-19-8-7-16(11-21-19)25(28)29)14(3)24(12)18-6-4-5-17(13(18)2)20(26)27/h4-11H,1-3H3,(H,21,23)(H,26,27)/p-1/b22-10+