3-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylamino]propanoic acid

Systemtic Name: 3-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylamino]propanoic acid Openeye Name: 3-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylamino]propanoic acid CAS Name: 3-[(2,5-dimethyl-1-phenyl-3-pyrrolyl)methylamino]propanoic acid IUPAC Name: 3-[(2,5-dimethyl-1-phenylpyrrol-3-yl)methylamino]propanoic acid Traditional Name: 3-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylamino]propionic acid Formula: C16H20N2O2 MolecularWeight: 272.3422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)CNCCC(=O)O

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)CNCCC(=O)O

InChI

InChI=1S/C16H20N2O2/c1-12-10-14(11-17-9-8-16(19)20)13(2)18(12)15-6-4-3-5-7-15/h3-7,10,17H,8-9,11H2,1-2H3,(H,19,20)