(3R,4R,5S)-4-acetamido-5-azanyl-3-[(3S)-pent-1-en-3-yl]oxy-cyclohexene-1-carboxylic acid

Systemtic Name: (3R,4R,5S)-4-acetamido-5-azanyl-3-[(3S)-pent-1-en-3-yl]oxy-cyclohexene-1-carboxylic acid Openeye Name: (3R,4R,5S)-4-acetamido-5-amino-3-[(1S)-1-ethylallyloxy]cyclohexene-1-carboxylic acid CAS Name: (3R,4R,5S)-4-acetamido-5-amino-3-[(3S)-pent-1-en-3-yl]oxy-1-cyclohexenecarboxylic acid IUPAC Name: (3R,4R,5S)-4-acetamido-5-amino-3-[(3S)-pent-1-en-3-yl]oxycyclohexene-1-carboxylic acid Traditional Name: (3R,4R,5S)-4-acetamido-5-amino-3-[(1S)-1-ethylallyloxy]cyclohexene-1-carboxylic acid Formula: C14H22N2O4 MolecularWeight: 282.33548

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C=C)OC1C=C(CC(C1NC(=O)C)N)C(=O)O

Isomeric SMILES

CC[C@@H](C=C)O[C@@H]1C=C(C[C@@H]([C@H]1NC(=O)C)N)C(=O)O

InChI

InChI=1S/C14H22N2O4/c1-4-10(5-2)20-12-7-9(14(18)19)6-11(15)13(12)16-8(3)17/h4,7,10-13H,1,5-6,15H2,2-3H3,(H,16,17)(H,18,19)/t10-,11+,12-,13-/m1/s1