3-(hexadecylcarbamoylamino)-4-oxidanylidene-pentanoic acid

Systemtic Name: 3-(hexadecylcarbamoylamino)-4-oxidanylidene-pentanoic acid Openeye Name: 3-(hexadecylcarbamoylamino)-4-oxo-pentanoic acid CAS Name: 3-[[(hexadecylamino)-oxomethyl]amino]-4-oxopentanoic acid IUPAC Name: 3-(hexadecylcarbamoylamino)-4-oxopentanoic acid Traditional Name: 3-(cetylcarbamoylamino)-4-keto-valeric acid Formula: C22H42N2O4 MolecularWeight: 398.57988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=O)NC(CC(=O)O)C(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(=O)NC(CC(=O)O)C(=O)C

InChI

InChI=1S/C22H42N2O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23-22(28)24-20(19(2)25)18-21(26)27/h20H,3-18H2,1-2H3,(H,26,27)(H2,23,24,28)