ethyl 5-[bis(azanyl)methylideneamino]-2-[[(E)-octadec-9-enoyl]amino]pentanoate

Systemtic Name: ethyl 5-[bis(azanyl)methylideneamino]-2-[[(E)-octadec-9-enoyl]amino]pentanoate Openeye Name: ethyl 5-guanidino-2-[[(E)-octadec-9-enoyl]amino]pentanoate CAS Name: 5-(diaminomethylideneamino)-2-[[(E)-1-oxooctadec-9-enyl]amino]pentanoic acid ethyl ester IUPAC Name: ethyl 5-(diaminomethylideneamino)-2-[[(E)-octadec-9-enoyl]amino]pentanoate Traditional Name: 5-guanidino-2-[[(E)-octadec-9-enoyl]amino]valeric acid ethyl ester Formula: C26H50N4O3 MolecularWeight: 466.7002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NC(CCCN=C(N)N)C(=O)OCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)NC(CCCN=C(N)N)C(=O)OCC

InChI

InChI=1S/C26H50N4O3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24(31)30-23(25(32)33-4-2)20-19-22-29-26(27)28/h11-12,23H,3-10,13-22H2,1-2H3,(H,30,31)(H4,27,28,29)/b12-11+