(2S,3S)-2-[(3-ethanoylphenyl)carbamoylamino]-3-methyl-pentanoate

Systemtic Name: (2S,3S)-2-[(3-ethanoylphenyl)carbamoylamino]-3-methyl-pentanoate Openeye Name: (2S,3S)-2-[(3-acetylphenyl)carbamoylamino]-3-methyl-pentanoate CAS Name: (2S,3S)-2-[[(3-acetylanilino)-oxomethyl]amino]-3-methylpentanoate IUPAC Name: (2S,3S)-2-[(3-acetylphenyl)carbamoylamino]-3-methylpentanoate Traditional Name: (2S,3S)-2-[(3-acetylphenyl)carbamoylamino]-3-methyl-valerate Formula: C15H19N2O4- MolecularWeight: 291.32236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)NC1=CC=CC(=C1)C(=O)C

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)[O-])NC(=O)NC1=CC=CC(=C1)C(=O)C

InChI

InChI=1S/C15H20N2O4/c1-4-9(2)13(14(19)20)17-15(21)16-12-7-5-6-11(8-12)10(3)18/h5-9,13H,4H2,1-3H3,(H,19,20)(H2,16,17,21)/p-1/t9-,13-/m0/s1