8-[3-[bis(2-hydroxyethyl)azaniumyl]propylcarbamoyl]naphthalene-1-carboxylate

Systemtic Name: 8-[3-[bis(2-hydroxyethyl)azaniumyl]propylcarbamoyl]naphthalene-1-carboxylate Openeye Name: 8-[3-[bis(2-hydroxyethyl)ammonio]propylcarbamoyl]naphthalene-1-carboxylate CAS Name: 8-[[3-[bis(2-hydroxyethyl)ammonio]propylamino]-oxomethyl]-1-naphthalenecarboxylate IUPAC Name: 8-[3-[bis(2-hydroxyethyl)azaniumyl]propylcarbamoyl]naphthalene-1-carboxylate Traditional Name: 8-[3-[bis(2-hydroxyethyl)ammonio]propylcarbamoyl]-1-naphthoate Formula: C19H24N2O5 MolecularWeight: 360.40426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C(=O)NCCC[NH+](CCO)CCO)C(=CC=C2)C(=O)[O-]

Isomeric SMILES

C1=CC2=C(C(=C1)C(=O)NCCC[NH+](CCO)CCO)C(=CC=C2)C(=O)[O-]

InChI

InChI=1S/C19H24N2O5/c22-12-10-21(11-13-23)9-3-8-20-18(24)15-6-1-4-14-5-2-7-16(17(14)15)19(25)26/h1-2,4-7,22-23H,3,8-13H2,(H,20,24)(H,25,26)