(phenylmethyl) N-[(2S)-3-(4-hydroxyphenyl)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-3-(4-hydroxyphenyl)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-2-(allylamino)-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-3-(4-hydroxyphenyl)-1-oxo-1-(prop-2-enylamino)propan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-3-(4-hydroxyphenyl)-1-oxo-1-(prop-2-enylamino)propan-2-yl]carbamate Traditional Name: N-[(1S)-2-(allylamino)-1-(4-hydroxybenzyl)-2-keto-ethyl]carbamic acid benzyl ester Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C(CC1=CC=C(C=C1)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C=CCNC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H22N2O4/c1-2-12-21-19(24)18(13-15-8-10-17(23)11-9-15)22-20(25)26-14-16-6-4-3-5-7-16/h2-11,18,23H,1,12-14H2,(H,21,24)(H,22,25)/t18-/m0/s1