4-acetamidobenzoic acid; 2-[methyl(3-methylbutyl)amino]ethanol

Systemtic Name: 4-acetamidobenzoic acid; 2-[methyl(3-methylbutyl)amino]ethanol Openeye Name: 4-acetamidobenzoic acid; 2-[isopentyl(methyl)amino]ethanol CAS Name: 4-acetamidobenzoic acid; 2-[methyl(3-methylbutyl)amino]ethanol IUPAC Name: 4-acetamidobenzoic acid; 2-[methyl(3-methylbutyl)amino]ethanol Traditional Name: 4-acetamidobenzoic acid; 2-[isoamyl(methyl)amino]ethanol Formula: C17H28N2O4 MolecularWeight: 324.41522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(C)CCO.CC(=O)NC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CC(C)CCN(C)CCO.CC(=O)NC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C9H9NO3.C8H19NO/c1-6(11)10-8-4-2-7(3-5-8)9(12)13;1-8(2)4-5-9(3)6-7-10/h2-5H,1H3,(H,10,11)(H,12,13);8,10H,4-7H2,1-3H3