ethyl 3-[[1-[2-(4-chlorophenyl)ethylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]aziridine-2-carboxylate

Systemtic Name: ethyl 3-[[1-[2-(4-chlorophenyl)ethylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]aziridine-2-carboxylate Openeye Name: ethyl 3-[[1-benzyl-2-[2-(4-chlorophenyl)ethylamino]-2-oxo-ethyl]carbamoyl]aziridine-2-carboxylate CAS Name: 3-[[[1-[2-(4-chlorophenyl)ethylamino]-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-2-aziridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[1-[2-(4-chlorophenyl)ethylamino]-1-oxo-3-phenylpropan-2-yl]carbamoyl]aziridine-2-carboxylate Traditional Name: 3-[[1-benzyl-2-[2-(4-chlorophenyl)ethylamino]-2-keto-ethyl]carbamoyl]ethylenimine-2-carboxylic acid ethyl ester Formula: C23H26ClN3O4 MolecularWeight: 443.92324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N1)C(=O)NC(CC2=CC=CC=C2)C(=O)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1C(N1)C(=O)NC(CC2=CC=CC=C2)C(=O)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H26ClN3O4/c1-2-31-23(30)20-19(27-20)22(29)26-18(14-16-6-4-3-5-7-16)21(28)25-13-12-15-8-10-17(24)11-9-15/h3-11,18-20,27H,2,12-14H2,1H3,(H,25,28)(H,26,29)