cyclopentyl 7,7-dimethyl-2-methylidene-4-(6-nitro-1,3-benzodioxol-5-yl)-5-oxidanylidene-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: cyclopentyl 7,7-dimethyl-2-methylidene-4-(6-nitro-1,3-benzodioxol-5-yl)-5-oxidanylidene-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: cyclopentyl 7,7-dimethyl-2-methylene-4-(6-nitro-1,3-benzodioxol-5-yl)-5-oxo-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 7,7-dimethyl-2-methylene-4-(6-nitro-1,3-benzodioxol-5-yl)-5-oxo-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylic acid cyclopentyl ester IUPAC Name: cyclopentyl 7,7-dimethyl-2-methylidene-4-(6-nitro-1,3-benzodioxol-5-yl)-5-oxo-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 5-keto-7,7-dimethyl-2-methylene-4-(6-nitro-1,3-benzodioxol-5-yl)-3,4,6,8-tetrahydro-1H-quinoline-3-carboxylic acid cyclopentyl ester Formula: C25H28N2O7 MolecularWeight: 468.49902

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(C(=C)N2)C(=O)OC3CCCC3)C4=CC5=C(C=C4[N+](=O)[O-])OCO5)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(C(=C)N2)C(=O)OC3CCCC3)C4=CC5=C(C=C4[N+](=O)[O-])OCO5)C(=O)C1)C

InChI

InChI=1S/C25H28N2O7/c1-13-21(24(29)34-14-6-4-5-7-14)22(23-16(26-13)10-25(2,3)11-18(23)28)15-8-19-20(33-12-32-19)9-17(15)27(30)31/h8-9,14,21-22,26H,1,4-7,10-12H2,2-3H3