4-butoxy-2-(2,2-dimethylpropyl)-1-oxidanylidene-benzo[g]isoquinoline-3-carboxylic acid

Systemtic Name: 4-butoxy-2-(2,2-dimethylpropyl)-1-oxidanylidene-benzo[g]isoquinoline-3-carboxylic acid Openeye Name: 4-butoxy-2-(2,2-dimethylpropyl)-1-oxo-benzo[g]isoquinoline-3-carboxylic acid CAS Name: 4-butoxy-2-(2,2-dimethylpropyl)-1-oxo-3-benzo[g]isoquinolinecarboxylic acid IUPAC Name: 4-butoxy-2-(2,2-dimethylpropyl)-1-oxobenzo[g]isoquinoline-3-carboxylic acid Traditional Name: 4-butoxy-1-keto-2-neopentyl-benz[g]isoquinoline-3-carboxylic acid Formula: C23H27NO4 MolecularWeight: 381.46478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(N(C(=O)C2=CC3=CC=CC=C3C=C21)CC(C)(C)C)C(=O)O

Isomeric SMILES

CCCCOC1=C(N(C(=O)C2=CC3=CC=CC=C3C=C21)CC(C)(C)C)C(=O)O

InChI

InChI=1S/C23H27NO4/c1-5-6-11-28-20-17-12-15-9-7-8-10-16(15)13-18(17)21(25)24(14-23(2,3)4)19(20)22(26)27/h7-10,12-13H,5-6,11,14H2,1-4H3,(H,26,27)