(2S)-2-[2-[cyclohexyl(methyl)azaniumyl]ethanoylamino]-3-methyl-butanoate

Systemtic Name: (2S)-2-[2-[cyclohexyl(methyl)azaniumyl]ethanoylamino]-3-methyl-butanoate Openeye Name: (2S)-2-[[2-[cyclohexyl(methyl)ammonio]acetyl]amino]-3-methyl-butanoate CAS Name: (2S)-2-[[2-[cyclohexyl(methyl)ammonio]-1-oxoethyl]amino]-3-methylbutanoate IUPAC Name: (2S)-2-[[2-[cyclohexyl(methyl)azaniumyl]acetyl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[[2-[cyclohexyl(methyl)ammonio]acetyl]amino]-3-methyl-butyrate Formula: C14H26N2O3 MolecularWeight: 270.36784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC(=O)C[NH+](C)C1CCCCC1

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])NC(=O)C[NH+](C)C1CCCCC1

InChI

InChI=1S/C14H26N2O3/c1-10(2)13(14(18)19)15-12(17)9-16(3)11-7-5-4-6-8-11/h10-11,13H,4-9H2,1-3H3,(H,15,17)(H,18,19)/t13-/m0/s1