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

Systemtic Name: ethyl 3-[[1-(3-methoxypropylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]aziridine-2-carboxylate Openeye Name: ethyl 3-[[1-benzyl-2-(3-methoxypropylamino)-2-oxo-ethyl]carbamoyl]aziridine-2-carboxylate CAS Name: 3-[[[1-(3-methoxypropylamino)-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-2-aziridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[1-(3-methoxypropylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]aziridine-2-carboxylate Traditional Name: 3-[[1-benzyl-2-keto-2-(3-methoxypropylamino)ethyl]carbamoyl]ethylenimine-2-carboxylic acid ethyl ester Formula: C19H27N3O5 MolecularWeight: 377.43478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N1)C(=O)NC(CC2=CC=CC=C2)C(=O)NCCCOC

Isomeric SMILES

CCOC(=O)C1C(N1)C(=O)NC(CC2=CC=CC=C2)C(=O)NCCCOC

InChI

InChI=1S/C19H27N3O5/c1-3-27-19(25)16-15(22-16)18(24)21-14(12-13-8-5-4-6-9-13)17(23)20-10-7-11-26-2/h4-6,8-9,14-16,22H,3,7,10-12H2,1-2H3,(H,20,23)(H,21,24)