5-[[(3-acetamidophenyl)-ethyl-amino]methyl]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[[(3-acetamidophenyl)-ethyl-amino]methyl]benzene-1,3-dicarboxylic acid Openeye Name: 5-[(3-acetamido-N-ethyl-anilino)methyl]benzene-1,3-dicarboxylic acid CAS Name: 5-[(3-acetamido-N-ethylanilino)methyl]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[(3-acetamido-N-ethylanilino)methyl]benzene-1,3-dicarboxylic acid Traditional Name: 5-[(3-acetamido-N-ethyl-anilino)methyl]isophthalic acid Formula: C19H20N2O5 MolecularWeight: 356.3725

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=CC(=C1)C(=O)O)C(=O)O)C2=CC=CC(=C2)NC(=O)C

Isomeric SMILES

CCN(CC1=CC(=CC(=C1)C(=O)O)C(=O)O)C2=CC=CC(=C2)NC(=O)C

InChI

InChI=1S/C19H20N2O5/c1-3-21(17-6-4-5-16(10-17)20-12(2)22)11-13-7-14(18(23)24)9-15(8-13)19(25)26/h4-10H,3,11H2,1-2H3,(H,20,22)(H,23,24)(H,25,26)