4-azanyl-3-butyl-naphthalene-1,2-dicarboxylic acid

Systemtic Name: 4-azanyl-3-butyl-naphthalene-1,2-dicarboxylic acid Openeye Name: 4-amino-3-butyl-naphthalene-1,2-dicarboxylic acid CAS Name: 4-amino-3-butylnaphthalene-1,2-dicarboxylic acid IUPAC Name: 4-amino-3-butylnaphthalene-1,2-dicarboxylic acid Traditional Name: 4-amino-3-butyl-naphthalene-1,2-dicarboxylic acid Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2C(=C1C(=O)O)C(=O)O)N

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2C(=C1C(=O)O)C(=O)O)N

InChI

InChI=1S/C16H17NO4/c1-2-3-6-11-13(16(20)21)12(15(18)19)9-7-4-5-8-10(9)14(11)17/h4-5,7-8H,2-3,6,17H2,1H3,(H,18,19)(H,20,21)