(2-azanyl-4-methyl-pentyl)-carboxy-(phenylmethyl)-propyl-azanium

Systemtic Name: (2-azanyl-4-methyl-pentyl)-carboxy-(phenylmethyl)-propyl-azanium Openeye Name: (2-amino-4-methyl-pentyl)-benzyl-carboxy-propyl-ammonium CAS Name: (2-amino-4-methylpentyl)-carboxy-(phenylmethyl)-propylammonium IUPAC Name: (2-amino-4-methylpentyl)-benzyl-carboxy-propylazanium Traditional Name: (2-amino-4-methyl-pentyl)-benzyl-carboxy-propyl-ammonium Formula: C17H29N2O2+ MolecularWeight: 293.42436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H28N2O2/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/p+1