2-[[3-ethoxycarbonyl-5-oxidanylidene-1-(phenylmethyl)-2H-pyrrol-4-yl]amino]ethanoic acid

Systemtic Name: 2-[[3-ethoxycarbonyl-5-oxidanylidene-1-(phenylmethyl)-2H-pyrrol-4-yl]amino]ethanoic acid Openeye Name: 2-[(1-benzyl-3-ethoxycarbonyl-5-oxo-2H-pyrrol-4-yl)amino]acetic acid CAS Name: 2-[[3-ethoxycarbonyl-5-oxo-1-(phenylmethyl)-2H-pyrrol-4-yl]amino]acetic acid IUPAC Name: 2-[(1-benzyl-3-ethoxycarbonyl-5-oxo-2H-pyrrol-4-yl)amino]acetic acid Traditional Name: 2-[(1-benzyl-4-carbethoxy-2-keto-3-pyrrolin-3-yl)amino]acetic acid Formula: C16H18N2O5 MolecularWeight: 318.32452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)N(C1)CC2=CC=CC=C2)NCC(=O)O

Isomeric SMILES

CCOC(=O)C1=C(C(=O)N(C1)CC2=CC=CC=C2)NCC(=O)O

InChI

InChI=1S/C16H18N2O5/c1-2-23-16(22)12-10-18(9-11-6-4-3-5-7-11)15(21)14(12)17-8-13(19)20/h3-7,17H,2,8-10H2,1H3,(H,19,20)