2-[3-formamido-1-methyl-4-(phenylmethyl)pyrrol-2-yl]propanoic acid

Systemtic Name: 2-[3-formamido-1-methyl-4-(phenylmethyl)pyrrol-2-yl]propanoic acid Openeye Name: 2-(4-benzyl-3-formamido-1-methyl-pyrrol-2-yl)propanoic acid CAS Name: 2-[3-formamido-1-methyl-4-(phenylmethyl)-2-pyrrolyl]propanoic acid IUPAC Name: 2-(4-benzyl-3-formamido-1-methylpyrrol-2-yl)propanoic acid Traditional Name: 2-(4-benzyl-3-formamido-1-methyl-pyrrol-2-yl)propionic acid Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C(=CN1C)CC2=CC=CC=C2)NC=O)C(=O)O

Isomeric SMILES

CC(C1=C(C(=CN1C)CC2=CC=CC=C2)NC=O)C(=O)O

InChI

InChI=1S/C16H18N2O3/c1-11(16(20)21)15-14(17-10-19)13(9-18(15)2)8-12-6-4-3-5-7-12/h3-7,9-11H,8H2,1-2H3,(H,17,19)(H,20,21)