7-[4-azanylbutyl(ethyl)amino]naphthalene-1,2-dicarboxylic acid

Systemtic Name: 7-[4-azanylbutyl(ethyl)amino]naphthalene-1,2-dicarboxylic acid Openeye Name: 7-[4-aminobutyl(ethyl)amino]naphthalene-1,2-dicarboxylic acid CAS Name: 7-[4-aminobutyl(ethyl)amino]naphthalene-1,2-dicarboxylic acid IUPAC Name: 7-[4-aminobutyl(ethyl)amino]naphthalene-1,2-dicarboxylic acid Traditional Name: 7-[4-aminobutyl(ethyl)amino]naphthalene-1,2-dicarboxylic acid Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCCN)C1=CC2=C(C=C1)C=CC(=C2C(=O)O)C(=O)O

Isomeric SMILES

CCN(CCCCN)C1=CC2=C(C=C1)C=CC(=C2C(=O)O)C(=O)O

InChI

InChI=1S/C18H22N2O4/c1-2-20(10-4-3-9-19)13-7-5-12-6-8-14(17(21)22)16(18(23)24)15(12)11-13/h5-8,11H,2-4,9-10,19H2,1H3,(H,21,22)(H,23,24)