sodium (2R)-4-methyl-2-[[(2R)-4-methyl-2-(undec-10-enylamino)pentanoyl]amino]pentanoate

Systemtic Name: sodium (2R)-4-methyl-2-[[(2R)-4-methyl-2-(undec-10-enylamino)pentanoyl]amino]pentanoate Openeye Name: sodium (2R)-4-methyl-2-[[(2R)-4-methyl-2-(undec-10-enylamino)pentanoyl]amino]pentanoate CAS Name: sodium (2R)-4-methyl-2-[[(2R)-4-methyl-1-oxo-2-(undec-10-enylamino)pentyl]amino]pentanoate IUPAC Name: sodium (2R)-4-methyl-2-[[(2R)-4-methyl-2-(undec-10-enylamino)pentanoyl]amino]pentanoate Traditional Name: sodium (2R)-4-methyl-2-[[(2R)-4-methyl-2-(undec-10-enylamino)pentanoyl]amino]valerate Formula: C23H43N2NaO3 MolecularWeight: 418.58889

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC(C)C)C(=O)[O-])NCCCCCCCCCC=C.[Na+]

Isomeric SMILES

CC(C)C[C@H](C(=O)N[C@H](CC(C)C)C(=O)[O-])NCCCCCCCCCC=C.[Na+]

InChI

InChI=1S/C23H44N2O3.Na/c1-6-7-8-9-10-11-12-13-14-15-24-20(16-18(2)3)22(26)25-21(23(27)28)17-19(4)5;/h6,18-21,24H,1,7-17H2,2-5H3,(H,25,26)(H,27,28);/q;+1/p-1/t20-,21-;/m1./s1