methyl (1S,3R,3aS,6aR)-1-[4-(1,3-benzodioxol-5-yl)phenyl]-5-ethyl-4,6-bis(oxidanylidene)-3-(phenylmethyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylate

Systemtic Name: methyl (1S,3R,3aS,6aR)-1-[4-(1,3-benzodioxol-5-yl)phenyl]-5-ethyl-4,6-bis(oxidanylidene)-3-(phenylmethyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylate Openeye Name: methyl (1S,3R,3aS,6aR)-1-[4-(1,3-benzodioxol-5-yl)phenyl]-3-benzyl-5-ethyl-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylate CAS Name: (1S,3R,3aS,6aR)-1-[4-(1,3-benzodioxol-5-yl)phenyl]-5-ethyl-4,6-dioxo-3-(phenylmethyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl (1S,3R,3aS,6aR)-1-[4-(1,3-benzodioxol-5-yl)phenyl]-3-benzyl-5-ethyl-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylate Traditional Name: (1S,3R,3aS,6aR)-1-[4-(1,3-benzodioxol-5-yl)phenyl]-3-benzyl-5-ethyl-4,6-diketo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid methyl ester Formula: C30H28N2O6 MolecularWeight: 512.55312

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2C(C1=O)C(NC2C3=CC=C(C=C3)C4=CC5=C(C=C4)OCO5)(CC6=CC=CC=C6)C(=O)OC

Isomeric SMILES

CCN1C(=O)[C@@H]2[C@H](C1=O)[C@](N[C@@H]2C3=CC=C(C=C3)C4=CC5=C(C=C4)OCO5)(CC6=CC=CC=C6)C(=O)OC

InChI

InChI=1S/C30H28N2O6/c1-3-32-27(33)24-25(28(32)34)30(29(35)36-2,16-18-7-5-4-6-8-18)31-26(24)20-11-9-19(10-12-20)21-13-14-22-23(15-21)38-17-37-22/h4-15,24-26,31H,3,16-17H2,1-2H3/t24-,25-,26-,30-/m1/s1