5-(3-chloranyl-4-methyl-phenyl)-3-(1-hydroxyethyl)-1-naphthalen-1-yl-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 5-(3-chloranyl-4-methyl-phenyl)-3-(1-hydroxyethyl)-1-naphthalen-1-yl-4,6-bis(oxidanylidene)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 5-(3-chloro-4-methyl-phenyl)-3-(1-hydroxyethyl)-1-(1-naphthyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 5-(3-chloro-4-methylphenyl)-3-(1-hydroxyethyl)-1-(1-naphthalenyl)-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 5-(3-chloro-4-methylphenyl)-3-(1-hydroxyethyl)-1-naphthalen-1-yl-4,6-dioxo-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 5-(3-chloro-4-methyl-phenyl)-3-(1-hydroxyethyl)-4,6-diketo-1-(1-naphthyl)-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C26H23ClN2O5 MolecularWeight: 478.92422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3C(C2=O)C(NC3C4=CC=CC5=CC=CC=C54)(C(C)O)C(=O)O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3C(C2=O)C(NC3C4=CC=CC5=CC=CC=C54)(C(C)O)C(=O)O)Cl

InChI

InChI=1S/C26H23ClN2O5/c1-13-10-11-16(12-19(13)27)29-23(31)20-21(24(29)32)26(14(2)30,25(33)34)28-22(20)18-9-5-7-15-6-3-4-8-17(15)18/h3-12,14,20-22,28,30H,1-2H3,(H,33,34)