methyl 4-(1,3-benzodioxol-5-yloxymethyl)-2-phenyl-1-(phenylmethyl)-2,5-dihydropyrrole-3-carboxylate

Systemtic Name: methyl 4-(1,3-benzodioxol-5-yloxymethyl)-2-phenyl-1-(phenylmethyl)-2,5-dihydropyrrole-3-carboxylate Openeye Name: methyl 4-(1,3-benzodioxol-5-yloxymethyl)-1-benzyl-2-phenyl-2,5-dihydropyrrole-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-yloxymethyl)-2-phenyl-1-(phenylmethyl)-2,5-dihydropyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(1,3-benzodioxol-5-yloxymethyl)-1-benzyl-2-phenyl-2,5-dihydropyrrole-3-carboxylate Traditional Name: 4-(1,3-benzodioxol-5-yloxymethyl)-1-benzyl-2-phenyl-3-pyrroline-3-carboxylic acid methyl ester Formula: C27H25NO5 MolecularWeight: 443.4911

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(CN(C1C2=CC=CC=C2)CC3=CC=CC=C3)COC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC(=O)C1=C(CN(C1C2=CC=CC=C2)CC3=CC=CC=C3)COC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H25NO5/c1-30-27(29)25-21(17-31-22-12-13-23-24(14-22)33-18-32-23)16-28(15-19-8-4-2-5-9-19)26(25)20-10-6-3-7-11-20/h2-14,26H,15-18H2,1H3