3-azanyl-4-butoxy-benzoic acid; N,N-diethylethanamine

Systemtic Name: 3-azanyl-4-butoxy-benzoic acid; N,N-diethylethanamine Openeye Name: 3-amino-4-butoxy-benzoic acid; N,N-diethylethanamine CAS Name: 3-amino-4-butoxybenzoic acid; N,N-diethylethanamine IUPAC Name: 3-amino-4-butoxybenzoic acid; N,N-diethylethanamine Traditional Name: 3-amino-4-butoxy-benzoic acid; triethylamine Formula: C17H30N2O3 MolecularWeight: 310.4317

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15NO3.C6H15N/c1-2-3-6-15-10-5-4-8(11(13)14)7-9(10)12;1-4-7(5-2)6-3/h4-5,7H,2-3,6,12H2,1H3,(H,13,14);4-6H2,1-3H3