ethyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-4-nitro-benzoate

Systemtic Name: ethyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-4-nitro-benzoate Openeye Name: ethyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-4-nitro-benzoate CAS Name: 2-[2-[(4-carbamimidoylanilino)-oxomethyl]phenyl]-4-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-4-nitrobenzoate Traditional Name: 2-[2-[(4-amidinophenyl)carbamoyl]phenyl]-4-nitro-benzoic acid ethyl ester Formula: C23H20N4O5 MolecularWeight: 432.4287

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])C2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CCOC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])C2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C23H20N4O5/c1-2-32-23(29)19-12-11-16(27(30)31)13-20(19)17-5-3-4-6-18(17)22(28)26-15-9-7-14(8-10-15)21(24)25/h3-13H,2H2,1H3,(H3,24,25)(H,26,28)