ethyl 4-(2-carbamimidoyl-5-nitro-phenyl)benzoate

Systemtic Name: ethyl 4-(2-carbamimidoyl-5-nitro-phenyl)benzoate Openeye Name: ethyl 4-(2-carbamimidoyl-5-nitro-phenyl)benzoate CAS Name: 4-(2-carbamimidoyl-5-nitrophenyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(2-carbamimidoyl-5-nitrophenyl)benzoate Traditional Name: 4-(2-amidino-5-nitro-phenyl)benzoic acid ethyl ester Formula: C16H15N3O4 MolecularWeight: 313.308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=C(C=CC(=C2)[N+](=O)[O-])C(=N)N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=C(C=CC(=C2)[N+](=O)[O-])C(=N)N

InChI

InChI=1S/C16H15N3O4/c1-2-23-16(20)11-5-3-10(4-6-11)14-9-12(19(21)22)7-8-13(14)15(17)18/h3-9H,2H2,1H3,(H3,17,18)