3-(naphthalen-2-ylmethyl)-5-(4-oxidanylbutyl)-4,6-bis(oxidanylidene)-1-(4-phenoxyphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 3-(naphthalen-2-ylmethyl)-5-(4-oxidanylbutyl)-4,6-bis(oxidanylidene)-1-(4-phenoxyphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 5-(4-hydroxybutyl)-3-(2-naphthylmethyl)-4,6-dioxo-1-(4-phenoxyphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 5-(4-hydroxybutyl)-3-(2-naphthalenylmethyl)-4,6-dioxo-1-(4-phenoxyphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 5-(4-hydroxybutyl)-3-(naphthalen-2-ylmethyl)-4,6-dioxo-1-(4-phenoxyphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 5-(4-hydroxybutyl)-4,6-diketo-3-(2-naphthylmethyl)-1-(4-phenoxyphenyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C34H32N2O6 MolecularWeight: 564.62768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3C4C(C(=O)N(C4=O)CCCCO)C(N3)(CC5=CC6=CC=CC=C6C=C5)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3C4C(C(=O)N(C4=O)CCCCO)C(N3)(CC5=CC6=CC=CC=C6C=C5)C(=O)O

InChI

InChI=1S/C34H32N2O6/c37-19-7-6-18-36-31(38)28-29(32(36)39)34(33(40)41,21-22-12-13-23-8-4-5-9-25(23)20-22)35-30(28)24-14-16-27(17-15-24)42-26-10-2-1-3-11-26/h1-5,8-17,20,28-30,35,37H,6-7,18-19,21H2,(H,40,41)