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

Systemtic Name: ethyl 3-[[1-[(4-chlorophenyl)methylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]aziridine-2-carboxylate Openeye Name: ethyl 3-[[1-benzyl-2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl]carbamoyl]aziridine-2-carboxylate CAS Name: 3-[[[1-[(4-chlorophenyl)methylamino]-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-2-aziridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[1-[(4-chlorophenyl)methylamino]-1-oxo-3-phenylpropan-2-yl]carbamoyl]aziridine-2-carboxylate Traditional Name: 3-[[1-benzyl-2-[(4-chlorobenzyl)amino]-2-keto-ethyl]carbamoyl]ethylenimine-2-carboxylic acid ethyl ester Formula: C22H24ClN3O4 MolecularWeight: 429.89666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N1)C(=O)NC(CC2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1C(N1)C(=O)NC(CC2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H24ClN3O4/c1-2-30-22(29)19-18(26-19)21(28)25-17(12-14-6-4-3-5-7-14)20(27)24-13-15-8-10-16(23)11-9-15/h3-11,17-19,26H,2,12-13H2,1H3,(H,24,27)(H,25,28)