[3-acetyloxy-2,2-dimethyl-4-[[3-[3-[[(E)-octadec-9-enoyl]amino]propylamino]-3-oxidanylidene-propyl]amino]-4-oxidanylidene-butyl] ethanoate

Systemtic Name: [3-acetyloxy-2,2-dimethyl-4-[[3-[3-[[(E)-octadec-9-enoyl]amino]propylamino]-3-oxidanylidene-propyl]amino]-4-oxidanylidene-butyl] ethanoate Openeye Name: [3-acetoxy-2,2-dimethyl-4-[[3-[3-[[(E)-octadec-9-enoyl]amino]propylamino]-3-oxo-propyl]amino]-4-oxo-butyl] acetate CAS Name: acetic acid [3-acetyloxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-[3-[[(E)-1-oxooctadec-9-enyl]amino]propylamino]propyl]amino]butyl] ester IUPAC Name: [3-acetyloxy-2,2-dimethyl-4-[[3-[3-[[(E)-octadec-9-enoyl]amino]propylamino]-3-oxopropyl]amino]-4-oxobutyl] acetate Traditional Name: acetic acid [3-acetoxy-4-keto-4-[[3-keto-3-[3-[[(E)-octadec-9-enoyl]amino]propylamino]propyl]amino]-2,2-dimethyl-butyl] ester Formula: C34H61N3O7 MolecularWeight: 623.86404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NCCCNC(=O)CCNC(=O)C(C(C)(C)COC(=O)C)OC(=O)C

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)NCCCNC(=O)CCNC(=O)C(C(C)(C)COC(=O)C)OC(=O)C

InChI

InChI=1S/C34H61N3O7/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-30(40)35-24-21-25-36-31(41)23-26-37-33(42)32(44-29(3)39)34(4,5)27-43-28(2)38/h13-14,32H,6-12,15-27H2,1-5H3,(H,35,40)(H,36,41)(H,37,42)/b14-13+