benzoic acid; 2-[bis(phenylmethyl)amino]ethanol; hydrochloride

Systemtic Name: benzoic acid; 2-[bis(phenylmethyl)amino]ethanol; hydrochloride Openeye Name: benzoic acid; 2-(dibenzylamino)ethanol; hydrochloride CAS Name: benzoic acid; 2-[bis(phenylmethyl)amino]ethanol; hydrochloride IUPAC Name: benzoic acid; 2-(dibenzylamino)ethanol; hydrochloride Traditional Name: benzoic acid; 2-(dibenzylamino)ethanol; hydrochloride Formula: C23H26ClNO3 MolecularWeight: 399.91044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCO)CC2=CC=CC=C2.C1=CC=C(C=C1)C(=O)O.Cl

Isomeric SMILES

C1=CC=C(C=C1)CN(CCO)CC2=CC=CC=C2.C1=CC=C(C=C1)C(=O)O.Cl

InChI

InChI=1S/C16H19NO.C7H6O2.ClH/c18-12-11-17(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16;8-7(9)6-4-2-1-3-5-6;/h1-10,18H,11-14H2;1-5H,(H,8,9);1H