(phenylmethyl) 2-azanyl-6-(phenylmethoxycarbonylamino)hexanoate hydrochloride

Systemtic Name: (phenylmethyl) 2-azanyl-6-(phenylmethoxycarbonylamino)hexanoate hydrochloride Openeye Name: benzyl 2-amino-6-(benzyloxycarbonylamino)hexanoate hydrochloride CAS Name: 2-amino-6-(phenylmethoxycarbonylamino)hexanoic acid (phenylmethyl) ester hydrochloride IUPAC Name: benzyl 2-amino-6-(phenylmethoxycarbonylamino)hexanoate hydrochloride Traditional Name: 2-amino-6-(benzyloxycarbonylamino)hexanoic acid benzyl ester hydrochloride Formula: C21H27ClN2O4 MolecularWeight: 406.90308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CCCCNC(=O)OCC2=CC=CC=C2)N.Cl

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(CCCCNC(=O)OCC2=CC=CC=C2)N.Cl

InChI

InChI=1S/C21H26N2O4.ClH/c22-19(20(24)26-15-17-9-3-1-4-10-17)13-7-8-14-23-21(25)27-16-18-11-5-2-6-12-18;/h1-6,9-12,19H,7-8,13-16,22H2,(H,23,25);1H