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

Systemtic Name: azanyl 3-[[4-(2-cyanophenyl)phenyl]methyl]-2-nitro-benzoate Openeye Name: amino 3-[[4-(2-cyanophenyl)phenyl]methyl]-2-nitro-benzoate CAS Name: 3-[[4-(2-cyanophenyl)phenyl]methyl]-2-nitrobenzoic acid amino ester IUPAC Name: amino 3-[[4-(2-cyanophenyl)phenyl]methyl]-2-nitrobenzoate Traditional Name: 3-[4-(2-cyanophenyl)benzyl]-2-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)C#N)C2=CC=C(C=C2)CC3=CC=CC(=C3[N+](=O)[O-])C(=O)ON

Isomeric SMILES

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

InChI

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