bis(phenylmethyl) 2,6-bis(azanyl)heptanedioate hydrochloride

Systemtic Name: bis(phenylmethyl) 2,6-bis(azanyl)heptanedioate hydrochloride Openeye Name: dibenzyl 2,6-diaminoheptanedioate hydrochloride CAS Name: 2,6-diaminoheptanedioic acid bis(phenylmethyl) ester hydrochloride IUPAC Name: dibenzyl 2,6-diaminoheptanedioate hydrochloride Traditional Name: 2,6-diaminopimelic acid dibenzyl 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(CCCC(C(=O)OCC2=CC=CC=C2)N)N.Cl

Isomeric SMILES

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

InChI

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