methyl 1-(1-adamantyl)-5-(3-methylphenyl)-4,6-bis(oxidanylidene)pyrrolo[3,4-c]pyrazole-3-carboxylate

Systemtic Name: methyl 1-(1-adamantyl)-5-(3-methylphenyl)-4,6-bis(oxidanylidene)pyrrolo[3,4-c]pyrazole-3-carboxylate Openeye Name: methyl 1-(1-adamantyl)-5-(m-tolyl)-4,6-dioxo-pyrrolo[3,4-c]pyrazole-3-carboxylate CAS Name: 1-(1-adamantyl)-5-(3-methylphenyl)-4,6-dioxo-3-pyrrolo[3,4-c]pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-(1-adamantyl)-5-(3-methylphenyl)-4,6-dioxopyrrolo[3,4-c]pyrazole-3-carboxylate Traditional Name: 1-(1-adamantyl)-4,6-diketo-5-(m-tolyl)pyrrolo[3,4-c]pyrazole-3-carboxylic acid methyl ester Formula: C24H25N3O4 MolecularWeight: 419.473

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=C(C2=O)N(N=C3C(=O)OC)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=C(C2=O)N(N=C3C(=O)OC)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C24H25N3O4/c1-13-4-3-5-17(6-13)26-21(28)18-19(23(30)31-2)25-27(20(18)22(26)29)24-10-14-7-15(11-24)9-16(8-14)12-24/h3-6,14-16H,7-12H2,1-2H3