(2R)-2-[(4-ethanoyl-1H-pyrrol-2-yl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: (2R)-2-[(4-ethanoyl-1H-pyrrol-2-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: (2R)-2-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3-phenyl-propanoate CAS Name: (2R)-2-[[(4-acetyl-1H-pyrrol-2-yl)-oxomethyl]amino]-3-phenylpropanoate IUPAC Name: (2R)-2-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3-phenylpropanoate Traditional Name: (2R)-2-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3-phenyl-propionate Formula: C16H15N2O4- MolecularWeight: 299.3013

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)N[C@H](CC2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C16H16N2O4/c1-10(19)12-8-13(17-9-12)15(20)18-14(16(21)22)7-11-5-3-2-4-6-11/h2-6,8-9,14,17H,7H2,1H3,(H,18,20)(H,21,22)/p-1/t14-/m1/s1