3-(4-tert-butylphenyl)-2-methyl-1-oxidanylidene-7-propan-2-yl-3,4-dihydroisoquinoline-4-carboxylic acid

Systemtic Name: 3-(4-tert-butylphenyl)-2-methyl-1-oxidanylidene-7-propan-2-yl-3,4-dihydroisoquinoline-4-carboxylic acid Openeye Name: 3-(4-tert-butylphenyl)-7-isopropyl-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carboxylic acid CAS Name: 3-(4-tert-butylphenyl)-2-methyl-1-oxo-7-propan-2-yl-3,4-dihydroisoquinoline-4-carboxylic acid IUPAC Name: 3-(4-tert-butylphenyl)-2-methyl-1-oxo-7-propan-2-yl-3,4-dihydroisoquinoline-4-carboxylic acid Traditional Name: 3-(4-tert-butylphenyl)-7-isopropyl-1-keto-2-methyl-3,4-dihydroisoquinoline-4-carboxylic acid Formula: C24H29NO3 MolecularWeight: 379.49196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)C(C(N(C2=O)C)C3=CC=C(C=C3)C(C)(C)C)C(=O)O

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)C(C(N(C2=O)C)C3=CC=C(C=C3)C(C)(C)C)C(=O)O

InChI

InChI=1S/C24H29NO3/c1-14(2)16-9-12-18-19(13-16)22(26)25(6)21(20(18)23(27)28)15-7-10-17(11-8-15)24(3,4)5/h7-14,20-21H,1-6H3,(H,27,28)