cycloheptyl 4-(1,3-benzodioxol-5-yl)-2-methyl-5-oxidanylidene-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: cycloheptyl 4-(1,3-benzodioxol-5-yl)-2-methyl-5-oxidanylidene-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: cycloheptyl 4-(1,3-benzodioxol-5-yl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylic acid cycloheptyl ester IUPAC Name: cycloheptyl 4-(1,3-benzodioxol-5-yl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)-5-keto-2-methyl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylic acid cycloheptyl ester Formula: C25H29NO5 MolecularWeight: 423.50146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2C(=O)CCC=C2N1)C3=CC4=C(C=C3)OCO4)C(=O)OC5CCCCCC5

Isomeric SMILES

CC1=C(C(C2C(=O)CCC=C2N1)C3=CC4=C(C=C3)OCO4)C(=O)OC5CCCCCC5

InChI

InChI=1S/C25H29NO5/c1-15-22(25(28)31-17-7-4-2-3-5-8-17)23(24-18(26-15)9-6-10-19(24)27)16-11-12-20-21(13-16)30-14-29-20/h9,11-13,17,23-24,26H,2-8,10,14H2,1H3