[(1S)-2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 4-(aminocarbonylamino)benzoate

Systemtic Name: [(1S)-2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 4-(aminocarbonylamino)benzoate Openeye Name: [(1S)-2-(3-chloro-4-methoxy-anilino)-2-oxo-1-phenyl-ethyl] 4-ureidobenzoate CAS Name: 4-(carbamoylamino)benzoic acid [(1S)-2-(3-chloro-4-methoxyanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(3-chloro-4-methoxyanilino)-2-oxo-1-phenylethyl] 4-(carbamoylamino)benzoate Traditional Name: 4-ureidobenzoic acid [(1S)-2-(3-chloro-4-methoxy-anilino)-2-keto-1-phenyl-ethyl] ester Formula: C23H20ClN3O5 MolecularWeight: 453.875

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)NC(=O)N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)[C@H](C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)NC(=O)N)Cl

InChI

InChI=1S/C23H20ClN3O5/c1-31-19-12-11-17(13-18(19)24)26-21(28)20(14-5-3-2-4-6-14)32-22(29)15-7-9-16(10-8-15)27-23(25)30/h2-13,20H,1H3,(H,26,28)(H3,25,27,30)/t20-/m0/s1