[2-[(2S)-2-acetamido-5-[bis(azanyl)methylideneamino]pentanoyl]oxy-3-dodecanoyloxy-propyl] dodecanoate

Systemtic Name: [2-[(2S)-2-acetamido-5-[bis(azanyl)methylideneamino]pentanoyl]oxy-3-dodecanoyloxy-propyl] dodecanoate Openeye Name: [2-[(2S)-2-acetamido-5-guanidino-pentanoyl]oxy-3-dodecanoyloxy-propyl] dodecanoate CAS Name: dodecanoic acid [2-[(2S)-2-acetamido-5-(diaminomethylideneamino)-1-oxopentoxy]-3-(1-oxododecoxy)propyl] ester IUPAC Name: [2-[(2S)-2-acetamido-5-(diaminomethylideneamino)pentanoyl]oxy-3-dodecanoyloxypropyl] dodecanoate Traditional Name: lauric acid [2-[(2S)-2-acetamido-5-guanidino-pentanoyl]oxy-3-lauroyloxy-propyl] ester Formula: C35H66N4O7 MolecularWeight: 654.92114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCC)OC(=O)C(CCCN=C(N)N)NC(=O)C

Isomeric SMILES

CCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCC)OC(=O)[C@H](CCCN=C(N)N)NC(=O)C

InChI

InChI=1S/C35H66N4O7/c1-4-6-8-10-12-14-16-18-20-24-32(41)44-27-30(28-45-33(42)25-21-19-17-15-13-11-9-7-5-2)46-34(43)31(39-29(3)40)23-22-26-38-35(36)37/h30-31H,4-28H2,1-3H3,(H,39,40)(H4,36,37,38)/t31-/m0/s1