methyl (2S)-2-[cyclohexylcarbonyl-[(4-methoxyphenyl)methyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[cyclohexylcarbonyl-[(4-methoxyphenyl)methyl]amino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[cyclohexanecarbonyl-[(4-methoxyphenyl)methyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[cyclohexyl(oxo)methyl]-[(4-methoxyphenyl)methyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[cyclohexanecarbonyl-[(4-methoxyphenyl)methyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[cyclohexanecarbonyl(p-anisyl)amino]-3-phenyl-propionic acid methyl ester Formula: C25H27NO4 MolecularWeight: 405.48618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(C(CC2=CC=CC=C2)C(=O)OC)C(=O)[C]3CC[CH][CH][CH]3

Isomeric SMILES

COC1=CC=C(C=C1)CN([C@@H](CC2=CC=CC=C2)C(=O)OC)C(=O)[C]3CC[CH][CH][CH]3

InChI

InChI=1S/C25H27NO4/c1-29-22-15-13-20(14-16-22)18-26(24(27)21-11-7-4-8-12-21)23(25(28)30-2)17-19-9-5-3-6-10-19/h3-7,9-11,13-16,23H,8,12,17-18H2,1-2H3/t23-/m0/s1