azanyl 2-[(3-cyano-4-phenyl-phenyl)methyl]-3-nitro-benzoate

Systemtic Name: azanyl 2-[(3-cyano-4-phenyl-phenyl)methyl]-3-nitro-benzoate Openeye Name: amino 2-[(3-cyano-4-phenyl-phenyl)methyl]-3-nitro-benzoate CAS Name: 2-[(3-cyano-4-phenylphenyl)methyl]-3-nitrobenzoic acid amino ester IUPAC Name: amino 2-[(3-cyano-4-phenylphenyl)methyl]-3-nitrobenzoate Traditional Name: 2-(3-cyano-4-phenyl-benzyl)-3-nitro-benzoic acid amino ester Formula: C21H15N3O4 MolecularWeight: 373.3615

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=C(C=C2)CC3=C(C=CC=C3[N+](=O)[O-])C(=O)ON)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=C(C=C2)CC3=C(C=CC=C3[N+](=O)[O-])C(=O)ON)C#N

InChI

InChI=1S/C21H15N3O4/c22-13-16-11-14(9-10-17(16)15-5-2-1-3-6-15)12-19-18(21(25)28-23)7-4-8-20(19)24(26)27/h1-11H,12,23H2