[2-[2,5-bis(azanyl)pentanoyloxy]-3-carboxy-6-methyl-4-oxidanylidene-heptyl]-trimethyl-azanium

Systemtic Name: [2-[2,5-bis(azanyl)pentanoyloxy]-3-carboxy-6-methyl-4-oxidanylidene-heptyl]-trimethyl-azanium Openeye Name: [3-carboxy-2-(2,5-diaminopentanoyloxy)-6-methyl-4-oxo-heptyl]-trimethyl-ammonium CAS Name: [3-carboxy-2-(2,5-diamino-1-oxopentoxy)-6-methyl-4-oxoheptyl]-trimethylammonium IUPAC Name: [3-carboxy-2-(2,5-diaminopentanoyloxy)-6-methyl-4-oxoheptyl]-trimethylazanium Traditional Name: [3-carboxy-2-(2,5-diaminopentanoyloxy)-4-keto-6-methyl-heptyl]-trimethyl-ammonium Formula: C17H34N3O5+ MolecularWeight: 360.46896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C(C(C[N+](C)(C)C)OC(=O)C(CCCN)N)C(=O)O

Isomeric SMILES

CC(C)CC(=O)C(C(C[N+](C)(C)C)OC(=O)C(CCCN)N)C(=O)O

InChI

InChI=1S/C17H33N3O5/c1-11(2)9-13(21)15(16(22)23)14(10-20(3,4)5)25-17(24)12(19)7-6-8-18/h11-12,14-15H,6-10,18-19H2,1-5H3/p+1