2-[2-butoxy-4-(diethylamino)phenyl]carbonylbenzoic acid

Systemtic Name: 2-[2-butoxy-4-(diethylamino)phenyl]carbonylbenzoic acid Openeye Name: 2-[2-butoxy-4-(diethylamino)benzoyl]benzoic acid CAS Name: 2-[[2-butoxy-4-(diethylamino)phenyl]-oxomethyl]benzoic acid IUPAC Name: 2-[2-butoxy-4-(diethylamino)benzoyl]benzoic acid Traditional Name: 2-[2-butoxy-4-(diethylamino)benzoyl]benzoic acid Formula: C22H27NO4 MolecularWeight: 369.45408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)N(CC)CC)C(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)N(CC)CC)C(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C22H27NO4/c1-4-7-14-27-20-15-16(23(5-2)6-3)12-13-19(20)21(24)17-10-8-9-11-18(17)22(25)26/h8-13,15H,4-7,14H2,1-3H3,(H,25,26)