2-[3-[ethanoyl(quinolin-2-ylmethyl)amino]propoxymethyl]-6-methyl-benzoic acid

Systemtic Name: 2-[3-[ethanoyl(quinolin-2-ylmethyl)amino]propoxymethyl]-6-methyl-benzoic acid Openeye Name: 2-[3-[acetyl(2-quinolylmethyl)amino]propoxymethyl]-6-methyl-benzoic acid CAS Name: 2-[3-[acetyl(2-quinolinylmethyl)amino]propoxymethyl]-6-methylbenzoic acid IUPAC Name: 2-[3-[acetyl(quinolin-2-ylmethyl)amino]propoxymethyl]-6-methylbenzoic acid Traditional Name: 2-[3-[acetyl(2-quinolylmethyl)amino]propoxymethyl]-6-methyl-benzoic acid Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)COCCCN(CC2=NC3=CC=CC=C3C=C2)C(=O)C)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)COCCCN(CC2=NC3=CC=CC=C3C=C2)C(=O)C)C(=O)O

InChI

InChI=1S/C24H26N2O4/c1-17-7-5-9-20(23(17)24(28)29)16-30-14-6-13-26(18(2)27)15-21-12-11-19-8-3-4-10-22(19)25-21/h3-5,7-12H,6,13-16H2,1-2H3,(H,28,29)