bis[(2-hexadecanoylphenyl)methyl] 2-[2,3-bis(azanyl)-3-oxidanylidene-propyl]-3-oxidanylidene-butanedioate

Systemtic Name: bis[(2-hexadecanoylphenyl)methyl] 2-[2,3-bis(azanyl)-3-oxidanylidene-propyl]-3-oxidanylidene-butanedioate Openeye Name: bis[(2-hexadecanoylphenyl)methyl] 2-(2,3-diamino-3-oxo-propyl)-3-oxo-butanedioate CAS Name: 2-(2,3-diamino-3-oxopropyl)-3-oxobutanedioic acid bis[[2-(1-oxohexadecyl)phenyl]methyl] ester IUPAC Name: bis[(2-hexadecanoylphenyl)methyl] 2-(2,3-diamino-3-oxopropyl)-3-oxobutanedioate Traditional Name: 2-(2,3-diamino-3-keto-propyl)-3-keto-succinic acid bis(2-hexadecanoylbenzyl) ester Formula: C53H82N2O8 MolecularWeight: 875.22678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C1=CC=CC=C1COC(=O)C(CC(C(=O)N)N)C(=O)C(=O)OCC2=CC=CC=C2C(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C1=CC=CC=C1COC(=O)C(CC(C(=O)N)N)C(=O)C(=O)OCC2=CC=CC=C2C(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C53H82N2O8/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-37-48(56)44-35-31-29-33-42(44)40-62-52(60)46(39-47(54)51(55)59)50(58)53(61)63-41-43-34-30-32-36-45(43)49(57)38-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h29-36,46-47H,3-28,37-41,54H2,1-2H3,(H2,55,59)