4-azanylbenzoic acid; N-tert-butylpentan-1-amine; hydrochloride

Systemtic Name: 4-azanylbenzoic acid; N-tert-butylpentan-1-amine; hydrochloride Openeye Name: 4-aminobenzoic acid; N-tert-butylpentan-1-amine; hydrochloride CAS Name: 4-aminobenzoic acid; N-tert-butyl-1-pentanamine; hydrochloride IUPAC Name: 4-aminobenzoic acid; N-tert-butylpentan-1-amine; hydrochloride Traditional Name: 4-aminobenzoic acid; amyl(tert-butyl)amine; hydrochloride Formula: C16H29ClN2O2 MolecularWeight: 316.86666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(C)(C)C.C1=CC(=CC=C1C(=O)O)N.Cl

Isomeric SMILES

CCCCCNC(C)(C)C.C1=CC(=CC=C1C(=O)O)N.Cl

InChI

InChI=1S/C9H21N.C7H7NO2.ClH/c1-5-6-7-8-10-9(2,3)4;8-6-3-1-5(2-4-6)7(9)10;/h10H,5-8H2,1-4H3;1-4H,8H2,(H,9,10);1H