azane; 4-butyl-3-(ethylamino)naphthalene-1,2-dicarboxylic acid

Systemtic Name: azane; 4-butyl-3-(ethylamino)naphthalene-1,2-dicarboxylic acid Openeye Name: ammonia; 4-butyl-3-(ethylamino)naphthalene-1,2-dicarboxylic acid CAS Name: ammonia; 4-butyl-3-(ethylamino)naphthalene-1,2-dicarboxylic acid IUPAC Name: azane; 4-butyl-3-(ethylamino)naphthalene-1,2-dicarboxylic acid Traditional Name: ammonia; 4-butyl-3-(ethylamino)naphthalene-1,2-dicarboxylic acid Formula: C18H24N2O4 MolecularWeight: 332.39416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(C2=CC=CC=C21)C(=O)O)C(=O)O)NCC.N

Isomeric SMILES

CCCCC1=C(C(=C(C2=CC=CC=C21)C(=O)O)C(=O)O)NCC.N

InChI

InChI=1S/C18H21NO4.H3N/c1-3-5-8-13-11-9-6-7-10-12(11)14(17(20)21)15(18(22)23)16(13)19-4-2;/h6-7,9-10,19H,3-5,8H2,1-2H3,(H,20,21)(H,22,23);1H3