2-(heptan-2-ylamino)ethyl benzoate hydrochloride

Systemtic Name: 2-(heptan-2-ylamino)ethyl benzoate hydrochloride Openeye Name: 2-(1-methylhexylamino)ethyl benzoate hydrochloride CAS Name: benzoic acid 2-(heptan-2-ylamino)ethyl ester hydrochloride IUPAC Name: 2-(heptan-2-ylamino)ethyl benzoate hydrochloride Traditional Name: benzoic acid 2-(1-methylhexylamino)ethyl ester hydrochloride Formula: C16H26ClNO2 MolecularWeight: 299.83614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NCCOC(=O)C1=CC=CC=C1.Cl

Isomeric SMILES

CCCCCC(C)NCCOC(=O)C1=CC=CC=C1.Cl

InChI

InChI=1S/C16H25NO2.ClH/c1-3-4-6-9-14(2)17-12-13-19-16(18)15-10-7-5-8-11-15;/h5,7-8,10-11,14,17H,3-4,6,9,12-13H2,1-2H3;1H