prop-2-enyl N-[(2S)-4-azanyl-1,4-bis(oxidanylidene)-1-(phenethylamino)butan-2-yl]carbamate

Systemtic Name: prop-2-enyl N-[(2S)-4-azanyl-1,4-bis(oxidanylidene)-1-(phenethylamino)butan-2-yl]carbamate Openeye Name: allyl N-[(1S)-3-amino-3-oxo-1-(phenethylcarbamoyl)propyl]carbamate CAS Name: N-[(2S)-4-amino-1,4-dioxo-1-(phenethylamino)butan-2-yl]carbamic acid prop-2-enyl ester IUPAC Name: prop-2-enyl N-[(2S)-4-amino-1,4-dioxo-1-(phenethylamino)butan-2-yl]carbamate Traditional Name: N-[(1S)-3-amino-3-keto-1-(phenethylcarbamoyl)propyl]carbamic acid allyl ester Formula: C16H21N3O4 MolecularWeight: 319.35564

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)NC(CC(=O)N)C(=O)NCCC1=CC=CC=C1

Isomeric SMILES

C=CCOC(=O)N[C@@H](CC(=O)N)C(=O)NCCC1=CC=CC=C1

InChI

InChI=1S/C16H21N3O4/c1-2-10-23-16(22)19-13(11-14(17)20)15(21)18-9-8-12-6-4-3-5-7-12/h2-7,13H,1,8-11H2,(H2,17,20)(H,18,21)(H,19,22)/t13-/m0/s1