(phenylmethyl) N-[1-[(3-azanyl-2-oxidanyl-propyl)amino]-1-oxidanylidene-propan-2-yl]carbamate hydrochloride

Systemtic Name: (phenylmethyl) N-[1-[(3-azanyl-2-oxidanyl-propyl)amino]-1-oxidanylidene-propan-2-yl]carbamate hydrochloride Openeye Name: benzyl N-[2-[(3-amino-2-hydroxy-propyl)amino]-1-methyl-2-oxo-ethyl]carbamate hydrochloride CAS Name: N-[1-[(3-amino-2-hydroxypropyl)amino]-1-oxopropan-2-yl]carbamic acid (phenylmethyl) ester hydrochloride IUPAC Name: benzyl N-[1-[(3-amino-2-hydroxypropyl)amino]-1-oxopropan-2-yl]carbamate hydrochloride Traditional Name: N-[2-[(3-amino-2-hydroxy-propyl)amino]-2-keto-1-methyl-ethyl]carbamic acid benzyl ester hydrochloride Formula: C14H22ClN3O4 MolecularWeight: 331.79518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC(CN)O)NC(=O)OCC1=CC=CC=C1.Cl

Isomeric SMILES

CC(C(=O)NCC(CN)O)NC(=O)OCC1=CC=CC=C1.Cl

InChI

InChI=1S/C14H21N3O4.ClH/c1-10(13(19)16-8-12(18)7-15)17-14(20)21-9-11-5-3-2-4-6-11;/h2-6,10,12,18H,7-9,15H2,1H3,(H,16,19)(H,17,20);1H