(phenylmethyl) N-[4,9-bis(azanyl)-3-oxidanylidene-nonyl]carbamate hydrochloride

Systemtic Name: (phenylmethyl) N-[4,9-bis(azanyl)-3-oxidanylidene-nonyl]carbamate hydrochloride Openeye Name: benzyl N-(4,9-diamino-3-oxo-nonyl)carbamate hydrochloride CAS Name: N-(4,9-diamino-3-oxononyl)carbamic acid (phenylmethyl) ester hydrochloride IUPAC Name: benzyl N-(4,9-diamino-3-oxononyl)carbamate hydrochloride Traditional Name: N-(4,9-diamino-3-keto-nonyl)carbamic acid benzyl ester hydrochloride Formula: C17H28ClN3O3 MolecularWeight: 357.87552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCC(=O)C(CCCCCN)N.Cl

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCC(=O)C(CCCCCN)N.Cl

InChI

InChI=1S/C17H27N3O3.ClH/c18-11-6-2-5-9-15(19)16(21)10-12-20-17(22)23-13-14-7-3-1-4-8-14;/h1,3-4,7-8,15H,2,5-6,9-13,18-19H2,(H,20,22);1H