5-(dimethylamino)-2-[4-[ethyl-(phenylmethyl)amino]phenyl]carbonyl-benzoic acid

Systemtic Name: 5-(dimethylamino)-2-[4-[ethyl-(phenylmethyl)amino]phenyl]carbonyl-benzoic acid Openeye Name: 2-[4-[benzyl(ethyl)amino]benzoyl]-5-(dimethylamino)benzoic acid CAS Name: 5-(dimethylamino)-2-[[4-[ethyl-(phenylmethyl)amino]phenyl]-oxomethyl]benzoic acid IUPAC Name: 2-[4-[benzyl(ethyl)amino]benzoyl]-5-(dimethylamino)benzoic acid Traditional Name: 2-[4-[benzyl(ethyl)amino]benzoyl]-5-(dimethylamino)benzoic acid Formula: C25H26N2O3 MolecularWeight: 402.48554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C(=O)C3=C(C=C(C=C3)N(C)C)C(=O)O

Isomeric SMILES

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C(=O)C3=C(C=C(C=C3)N(C)C)C(=O)O

InChI

InChI=1S/C25H26N2O3/c1-4-27(17-18-8-6-5-7-9-18)20-12-10-19(11-13-20)24(28)22-15-14-21(26(2)3)16-23(22)25(29)30/h5-16H,4,17H2,1-3H3,(H,29,30)