2-[[2,6-dimethoxy-4-(piperidin-1-ylmethyl)phenyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[2,6-dimethoxy-4-(piperidin-1-ylmethyl)phenyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[2,6-dimethoxy-4-(1-piperidylmethyl)anilino]-3-phenyl-propanoic acid CAS Name: 2-[2,6-dimethoxy-4-(1-piperidinylmethyl)anilino]-3-phenylpropanoic acid IUPAC Name: 2-[2,6-dimethoxy-4-(piperidin-1-ylmethyl)anilino]-3-phenylpropanoic acid Traditional Name: 2-[2,6-dimethoxy-4-(piperidinomethyl)anilino]-3-phenyl-propionic acid Formula: C23H30N2O4 MolecularWeight: 398.4953

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1NC(CC2=CC=CC=C2)C(=O)O)OC)CN3CCCCC3

Isomeric SMILES

COC1=CC(=CC(=C1NC(CC2=CC=CC=C2)C(=O)O)OC)CN3CCCCC3

InChI

InChI=1S/C23H30N2O4/c1-28-20-14-18(16-25-11-7-4-8-12-25)15-21(29-2)22(20)24-19(23(26)27)13-17-9-5-3-6-10-17/h3,5-6,9-10,14-15,19,24H,4,7-8,11-13,16H2,1-2H3,(H,26,27)