ethyl 3-[[(2S)-1-[2-(4-hydroxyphenyl)ethylamino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamoyl]oxirane-2-carboxylate

Systemtic Name: ethyl 3-[[(2S)-1-[2-(4-hydroxyphenyl)ethylamino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamoyl]oxirane-2-carboxylate Openeye Name: ethyl 3-[[(1S)-1-[2-(4-hydroxyphenyl)ethylcarbamoyl]-3-methyl-butyl]carbamoyl]oxirane-2-carboxylate CAS Name: 3-[[[(2S)-1-[2-(4-hydroxyphenyl)ethylamino]-4-methyl-1-oxopentan-2-yl]amino]-oxomethyl]-2-oxiranecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[(2S)-1-[2-(4-hydroxyphenyl)ethylamino]-4-methyl-1-oxopentan-2-yl]carbamoyl]oxirane-2-carboxylate Traditional Name: 3-[[(1S)-1-[2-(4-hydroxyphenyl)ethylcarbamoyl]-3-methyl-butyl]carbamoyl]oxirane-2-carboxylic acid ethyl ester Formula: C20H28N2O6 MolecularWeight: 392.44612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(O1)C(=O)NC(CC(C)C)C(=O)NCCC2=CC=C(C=C2)O

Isomeric SMILES

CCOC(=O)C1C(O1)C(=O)N[C@@H](CC(C)C)C(=O)NCCC2=CC=C(C=C2)O

InChI

InChI=1S/C20H28N2O6/c1-4-27-20(26)17-16(28-17)19(25)22-15(11-12(2)3)18(24)21-10-9-13-5-7-14(23)8-6-13/h5-8,12,15-17,23H,4,9-11H2,1-3H3,(H,21,24)(H,22,25)/t15-,16?,17?/m0/s1