3-azanyl-4-butoxy-benzoic acid; 2-(2-diethylaminoethyloxy)ethanol

Systemtic Name: 3-azanyl-4-butoxy-benzoic acid; 2-(2-diethylaminoethyloxy)ethanol Openeye Name: 3-amino-4-butoxy-benzoic acid; 2-(2-diethylaminoethyloxy)ethanol CAS Name: 3-amino-4-butoxybenzoic acid; 2-(2-diethylaminoethyloxy)ethanol IUPAC Name: 3-amino-4-butoxybenzoic acid; 2-(2-diethylaminoethyloxy)ethanol Traditional Name: 3-amino-4-butoxy-benzoic acid; 2-(2-diethylaminoethyloxy)ethanol Formula: C19H34N2O5 MolecularWeight: 370.48366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)O)N.CCN(CC)CCOCCO

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)O)N.CCN(CC)CCOCCO

InChI

InChI=1S/C11H15NO3.C8H19NO2/c1-2-3-6-15-10-5-4-8(11(13)14)7-9(10)12;1-3-9(4-2)5-7-11-8-6-10/h4-5,7H,2-3,6,12H2,1H3,(H,13,14);10H,3-8H2,1-2H3