[(2-azanyl-4-methyl-pentyl)-(phenylmethyl)-propyl-azaniumyl]methanoate hydrochloride

Systemtic Name: [(2-azanyl-4-methyl-pentyl)-(phenylmethyl)-propyl-azaniumyl]methanoate hydrochloride Openeye Name: [(2-amino-4-methyl-pentyl)-benzyl-propyl-ammonio]formate hydrochloride CAS Name: [(2-amino-4-methylpentyl)-(phenylmethyl)-propylammonio]formate hydrochloride IUPAC Name: [(2-amino-4-methylpentyl)-benzyl-propylazaniumyl]formate hydrochloride Traditional Name: [(2-amino-4-methyl-pentyl)-benzyl-propyl-ammonio]formate hydrochloride Formula: C17H29ClN2O2 MolecularWeight: 328.87736

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](CC1=CC=CC=C1)(CC(CC(C)C)N)C(=O)[O-].Cl

Isomeric SMILES

CCC[N+](CC1=CC=CC=C1)(CC(CC(C)C)N)C(=O)[O-].Cl

InChI

InChI=1S/C17H28N2O2.ClH/c1-4-10-19(17(20)21,13-16(18)11-14(2)3)12-15-8-6-5-7-9-15;/h5-9,14,16H,4,10-13,18H2,1-3H3;1H