ethyl 3-[[(2R)-4-methyl-1-oxidanylidene-1-phenylmethoxy-pentan-2-yl]carbamoyl]aziridine-2-carboxylate

Systemtic Name: ethyl 3-[[(2R)-4-methyl-1-oxidanylidene-1-phenylmethoxy-pentan-2-yl]carbamoyl]aziridine-2-carboxylate Openeye Name: ethyl 3-[[(1R)-1-benzyloxycarbonyl-3-methyl-butyl]carbamoyl]aziridine-2-carboxylate CAS Name: 3-[[[(2R)-4-methyl-1-oxo-1-phenylmethoxypentan-2-yl]amino]-oxomethyl]-2-aziridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[(2R)-4-methyl-1-oxo-1-phenylmethoxypentan-2-yl]carbamoyl]aziridine-2-carboxylate Traditional Name: 3-[[(1R)-1-carbobenzoxy-3-methyl-butyl]carbamoyl]ethylenimine-2-carboxylic acid ethyl ester Formula: C19H26N2O5 MolecularWeight: 362.42014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N1)C(=O)NC(CC(C)C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1C(N1)C(=O)N[C@H](CC(C)C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H26N2O5/c1-4-25-19(24)16-15(21-16)17(22)20-14(10-12(2)3)18(23)26-11-13-8-6-5-7-9-13/h5-9,12,14-16,21H,4,10-11H2,1-3H3,(H,20,22)/t14-,15?,16?/m1/s1