octadecyl 6-aminocarbonyl-4-[(1-oxidanyl-2-oxidanylidene-propyl)carbamoyl]octanoate

Systemtic Name: octadecyl 6-aminocarbonyl-4-[(1-oxidanyl-2-oxidanylidene-propyl)carbamoyl]octanoate Openeye Name: octadecyl 6-carbamoyl-4-[(1-hydroxy-2-oxo-propyl)carbamoyl]octanoate CAS Name: 6-carbamoyl-4-[[(1-hydroxy-2-oxopropyl)amino]-oxomethyl]octanoic acid octadecyl ester IUPAC Name: octadecyl 6-carbamoyl-4-[(1-hydroxy-2-oxopropyl)carbamoyl]octanoate Traditional Name: 6-carbamoyl-4-[(1-hydroxy-2-keto-propyl)carbamoyl]caprylic acid stearyl ester Formula: C31H58N2O6 MolecularWeight: 554.80202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)CCC(CC(CC)C(=O)N)C(=O)NC(C(=O)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)CCC(CC(CC)C(=O)N)C(=O)NC(C(=O)C)O

InChI

InChI=1S/C31H58N2O6/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-39-28(35)22-21-27(24-26(5-2)29(32)36)31(38)33-30(37)25(3)34/h26-27,30,37H,4-24H2,1-3H3,(H2,32,36)(H,33,38)