methyl 3-(4-butoxyphenyl)-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: methyl 3-(4-butoxyphenyl)-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: methyl 2-(benzyloxycarbonylamino)-3-(4-butoxyphenyl)propanoate CAS Name: 3-(4-butoxyphenyl)-2-(phenylmethoxycarbonylamino)propanoic acid methyl ester IUPAC Name: methyl 3-(4-butoxyphenyl)-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-(4-butoxyphenyl)propionic acid methyl ester Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CC(C(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CC(C(=O)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H27NO5/c1-3-4-14-27-19-12-10-17(11-13-19)15-20(21(24)26-2)23-22(25)28-16-18-8-6-5-7-9-18/h5-13,20H,3-4,14-16H2,1-2H3,(H,23,25)