2-[carboxy-[2-(4-pyrrol-1-ylphenyl)ethyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[carboxy-[2-(4-pyrrol-1-ylphenyl)ethyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[carboxy-[2-(4-pyrrol-1-ylphenyl)ethyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[carboxy-[2-[4-(1-pyrrolyl)phenyl]ethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[carboxy-[2-(4-pyrrol-1-ylphenyl)ethyl]amino]-4-methylpentanoic acid Traditional Name: 2-[carboxy-[2-(4-pyrrol-1-ylphenyl)ethyl]amino]-4-methyl-valeric acid Formula: C19H24N2O4 MolecularWeight: 344.40486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCC1=CC=C(C=C1)N2C=CC=C2)C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCC1=CC=C(C=C1)N2C=CC=C2)C(=O)O

InChI

InChI=1S/C19H24N2O4/c1-14(2)13-17(18(22)23)21(19(24)25)12-9-15-5-7-16(8-6-15)20-10-3-4-11-20/h3-8,10-11,14,17H,9,12-13H2,1-2H3,(H,22,23)(H,24,25)