2-[[[4-(carboxymethyl)phenyl]-propyl-amino]methyl]benzoic acid

Systemtic Name: 2-[[[4-(carboxymethyl)phenyl]-propyl-amino]methyl]benzoic acid Openeye Name: 2-[[4-(carboxymethyl)-N-propyl-anilino]methyl]benzoic acid CAS Name: 2-[[4-(carboxymethyl)-N-propylanilino]methyl]benzoic acid IUPAC Name: 2-[[4-(carboxymethyl)-N-propylanilino]methyl]benzoic acid Traditional Name: 2-[[4-(carboxymethyl)-N-propyl-anilino]methyl]benzoic acid Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1C(=O)O)C2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

CCCN(CC1=CC=CC=C1C(=O)O)C2=CC=C(C=C2)CC(=O)O

InChI

InChI=1S/C19H21NO4/c1-2-11-20(13-15-5-3-4-6-17(15)19(23)24)16-9-7-14(8-10-16)12-18(21)22/h3-10H,2,11-13H2,1H3,(H,21,22)(H,23,24)