3-(1-acetamido-2-ethyl-butyl)-4-azanyl-2-(6-azanylhexylcarbamoyloxy)cyclopentane-1-carboxylic acid

Systemtic Name: 3-(1-acetamido-2-ethyl-butyl)-4-azanyl-2-(6-azanylhexylcarbamoyloxy)cyclopentane-1-carboxylic acid Openeye Name: 3-(1-acetamido-2-ethyl-butyl)-4-amino-2-(6-aminohexylcarbamoyloxy)cyclopentanecarboxylic acid CAS Name: 3-(1-acetamido-2-ethylbutyl)-4-amino-2-[(6-aminohexylamino)-oxomethoxy]-1-cyclopentanecarboxylic acid IUPAC Name: 3-(1-acetamido-2-ethylbutyl)-4-amino-2-(6-aminohexylcarbamoyloxy)cyclopentane-1-carboxylic acid Traditional Name: 3-(1-acetamido-2-ethyl-butyl)-4-amino-2-(6-aminohexylcarbamoyloxy)cyclopentanecarboxylic acid Formula: C21H40N4O5 MolecularWeight: 428.5661

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(C1C(CC(C1OC(=O)NCCCCCCN)C(=O)O)N)NC(=O)C

Isomeric SMILES

CCC(CC)C(C1C(CC(C1OC(=O)NCCCCCCN)C(=O)O)N)NC(=O)C

InChI

InChI=1S/C21H40N4O5/c1-4-14(5-2)18(25-13(3)26)17-16(23)12-15(20(27)28)19(17)30-21(29)24-11-9-7-6-8-10-22/h14-19H,4-12,22-23H2,1-3H3,(H,24,29)(H,25,26)(H,27,28)