sodium (2R)-3-methyl-2-[[(2R)-3-methyl-2-(undec-10-enylamino)butanoyl]amino]butanoate

Systemtic Name: sodium (2R)-3-methyl-2-[[(2R)-3-methyl-2-(undec-10-enylamino)butanoyl]amino]butanoate Openeye Name: sodium (2R)-3-methyl-2-[[(2R)-3-methyl-2-(undec-10-enylamino)butanoyl]amino]butanoate CAS Name: sodium (2R)-3-methyl-2-[[(2R)-3-methyl-1-oxo-2-(undec-10-enylamino)butyl]amino]butanoate IUPAC Name: sodium (2R)-3-methyl-2-[[(2R)-3-methyl-2-(undec-10-enylamino)butanoyl]amino]butanoate Traditional Name: sodium (2R)-3-methyl-2-[[(2R)-3-methyl-2-(undec-10-enylamino)butanoyl]amino]butyrate Formula: C21H39N2NaO3 MolecularWeight: 390.53573

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H40N2O3.Na/c1-6-7-8-9-10-11-12-13-14-15-22-18(16(2)3)20(24)23-19(17(4)5)21(25)26;/h6,16-19,22H,1,7-15H2,2-5H3,(H,23,24)(H,25,26);/q;+1/p-1/t18-,19-;/m1./s1