methyl 3-[[2-(2,2-diphenyl-1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]-(phenylmethyl)amino]propanoate

Systemtic Name: methyl 3-[[2-(2,2-diphenyl-1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]-(phenylmethyl)amino]propanoate Openeye Name: methyl 3-[benzyl-[2-(2,2-diphenyl-1,3-benzodioxol-5-yl)-2-oxo-ethyl]amino]propanoate CAS Name: 3-[[2-(2,2-diphenyl-1,3-benzodioxol-5-yl)-2-oxoethyl]-(phenylmethyl)amino]propanoic acid methyl ester IUPAC Name: methyl 3-[benzyl-[2-(2,2-diphenyl-1,3-benzodioxol-5-yl)-2-oxoethyl]amino]propanoate Traditional Name: 3-[benzyl-[2-(2,2-diphenyl-1,3-benzodioxol-5-yl)-2-keto-ethyl]amino]propionic acid methyl ester Formula: C32H29NO5 MolecularWeight: 507.57636

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN(CC1=CC=CC=C1)CC(=O)C2=CC3=C(C=C2)OC(O3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)CCN(CC1=CC=CC=C1)CC(=O)C2=CC3=C(C=C2)OC(O3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H29NO5/c1-36-31(35)19-20-33(22-24-11-5-2-6-12-24)23-28(34)25-17-18-29-30(21-25)38-32(37-29,26-13-7-3-8-14-26)27-15-9-4-10-16-27/h2-18,21H,19-20,22-23H2,1H3