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

Systemtic Name: [3-[(2S)-2-azanyl-5-[bis(azanyl)methylideneamino]pentanoyl]oxy-2-oxidanyl-propyl] dodecanoate Openeye Name: [3-[(2S)-2-amino-5-guanidino-pentanoyl]oxy-2-hydroxy-propyl] dodecanoate CAS Name: dodecanoic acid [3-[(2S)-2-amino-5-(diaminomethylideneamino)-1-oxopentoxy]-2-hydroxypropyl] ester IUPAC Name: [3-[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]oxy-2-hydroxypropyl] dodecanoate Traditional Name: lauric acid [3-[(2S)-2-amino-5-guanidino-pentanoyl]oxy-2-hydroxy-propyl] ester Formula: C21H42N4O5 MolecularWeight: 430.58198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OCC(COC(=O)C(CCCN=C(N)N)N)O

Isomeric SMILES

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

InChI

InChI=1S/C21H42N4O5/c1-2-3-4-5-6-7-8-9-10-13-19(27)29-15-17(26)16-30-20(28)18(22)12-11-14-25-21(23)24/h17-18,26H,2-16,22H2,1H3,(H4,23,24,25)/t17?,18-/m0/s1