(phenylmethyl) N-(7-azanyl-1-chloranyl-2-oxidanylidene-heptan-3-yl)carbamate hydrochloride

Systemtic Name: (phenylmethyl) N-(7-azanyl-1-chloranyl-2-oxidanylidene-heptan-3-yl)carbamate hydrochloride Openeye Name: benzyl N-[5-amino-1-(2-chloroacetyl)pentyl]carbamate hydrochloride CAS Name: N-(7-amino-1-chloro-2-oxoheptan-3-yl)carbamic acid (phenylmethyl) ester hydrochloride IUPAC Name: benzyl N-(7-amino-1-chloro-2-oxoheptan-3-yl)carbamate hydrochloride Traditional Name: N-[5-amino-1-(2-chloroacetyl)pentyl]carbamic acid benzyl ester hydrochloride Formula: C15H22Cl2N2O3 MolecularWeight: 349.25278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCCCN)C(=O)CCl.Cl

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CCCCN)C(=O)CCl.Cl

InChI

InChI=1S/C15H21ClN2O3.ClH/c16-10-14(19)13(8-4-5-9-17)18-15(20)21-11-12-6-2-1-3-7-12;/h1-3,6-7,13H,4-5,8-11,17H2,(H,18,20);1H