2-benzamido-5-[(1-methylpyrrol-2-yl)methylamino]pentanoic acid

Systemtic Name: 2-benzamido-5-[(1-methylpyrrol-2-yl)methylamino]pentanoic acid Openeye Name: 2-benzamido-5-[(1-methylpyrrol-2-yl)methylamino]pentanoic acid CAS Name: 2-benzamido-5-[(1-methyl-2-pyrrolyl)methylamino]pentanoic acid IUPAC Name: 2-benzamido-5-[(1-methylpyrrol-2-yl)methylamino]pentanoic acid Traditional Name: 2-benzamido-5-[(1-methylpyrrol-2-yl)methylamino]valeric acid Formula: C18H23N3O3 MolecularWeight: 329.39352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CNCCCC(C(=O)O)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CN1C=CC=C1CNCCCC(C(=O)O)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H23N3O3/c1-21-12-6-9-15(21)13-19-11-5-10-16(18(23)24)20-17(22)14-7-3-2-4-8-14/h2-4,6-9,12,16,19H,5,10-11,13H2,1H3,(H,20,22)(H,23,24)