methyl 2-[[(2E,4Z)-2-methyldodeca-2,4-dienoyl]amino]-3-oxidanyl-propanoate

Systemtic Name: methyl 2-[[(2E,4Z)-2-methyldodeca-2,4-dienoyl]amino]-3-oxidanyl-propanoate Openeye Name: methyl 3-hydroxy-2-[[(2E,4Z)-2-methyldodeca-2,4-dienoyl]amino]propanoate CAS Name: 3-hydroxy-2-[[(2E,4Z)-2-methyl-1-oxododeca-2,4-dienyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-[[(2E,4Z)-2-methyldodeca-2,4-dienoyl]amino]propanoate Traditional Name: 3-hydroxy-2-[[(2E,4Z)-2-methyldodeca-2,4-dienoyl]amino]propionic acid methyl ester Formula: C17H29NO4 MolecularWeight: 311.41646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC=CC=C(C)C(=O)NC(CO)C(=O)OC

Isomeric SMILES

CCCCCCC/C=C\C=C(/C)\C(=O)NC(CO)C(=O)OC

InChI

InChI=1S/C17H29NO4/c1-4-5-6-7-8-9-10-11-12-14(2)16(20)18-15(13-19)17(21)22-3/h10-12,15,19H,4-9,13H2,1-3H3,(H,18,20)/b11-10-,14-12+