2-[[4-methoxy-1-(phenylmethoxymethyl)cyclohexyl]carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[4-methoxy-1-(phenylmethoxymethyl)cyclohexyl]carbonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[1-(benzyloxymethyl)-4-methoxy-cyclohexanecarbonyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[[4-methoxy-1-(phenylmethoxymethyl)cyclohexyl]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[4-methoxy-1-(phenylmethoxymethyl)cyclohexanecarbonyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[1-(benzoxymethyl)-4-methoxy-cyclohexanecarbonyl]amino]-3-phenyl-propionic acid Formula: C25H31NO5 MolecularWeight: 425.51734

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCC(CC1)(COCC2=CC=CC=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

COC1CCC(CC1)(COCC2=CC=CC=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C25H31NO5/c1-30-21-12-14-25(15-13-21,18-31-17-20-10-6-3-7-11-20)24(29)26-22(23(27)28)16-19-8-4-2-5-9-19/h2-11,21-22H,12-18H2,1H3,(H,26,29)(H,27,28)