1-[3-methoxy-4-(3-methylbutoxy)phenyl]carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid

Systemtic Name: 1-[3-methoxy-4-(3-methylbutoxy)phenyl]carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-(4-isopentyloxy-3-methoxy-benzoyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[[3-methoxy-4-(3-methylbutoxy)phenyl]-oxomethyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-[3-methoxy-4-(3-methylbutoxy)benzoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-(4-isoamoxy-3-methoxy-benzoyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C23H27NO5 MolecularWeight: 397.46418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)N2CCCC3=C(C=CC=C32)C(=O)O)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)N2CCCC3=C(C=CC=C32)C(=O)O)OC

InChI

InChI=1S/C23H27NO5/c1-15(2)11-13-29-20-10-9-16(14-21(20)28-3)22(25)24-12-5-7-17-18(23(26)27)6-4-8-19(17)24/h4,6,8-10,14-15H,5,7,11-13H2,1-3H3,(H,26,27)