[(E)-[1-azanyl-2-(2-methoxyphenyl)ethylidene]amino] 4-methyl-3-nitro-benzoate

Systemtic Name: [(E)-[1-azanyl-2-(2-methoxyphenyl)ethylidene]amino] 4-methyl-3-nitro-benzoate Openeye Name: [(E)-[1-amino-2-(2-methoxyphenyl)ethylidene]amino] 4-methyl-3-nitro-benzoate CAS Name: 4-methyl-3-nitrobenzoic acid [(E)-[1-amino-2-(2-methoxyphenyl)ethylidene]amino] ester IUPAC Name: [(E)-[1-amino-2-(2-methoxyphenyl)ethylidene]amino] 4-methyl-3-nitrobenzoate Traditional Name: 4-methyl-3-nitro-benzoic acid [(E)-[1-amino-2-(2-methoxyphenyl)ethylidene]amino] ester Formula: C17H17N3O5 MolecularWeight: 343.33398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)ON=C(CC2=CC=CC=C2OC)N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O/N=C(\CC2=CC=CC=C2OC)/N)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O5/c1-11-7-8-13(9-14(11)20(22)23)17(21)25-19-16(18)10-12-5-3-4-6-15(12)24-2/h3-9H,10H2,1-2H3,(H2,18,19)