(E)-4-(2-acetyloxyethyl)-2-formamido-6-methyl-5-phosphono-5-propan-2-yl-hept-3-enoic acid

Systemtic Name: (E)-4-(2-acetyloxyethyl)-2-formamido-6-methyl-5-phosphono-5-propan-2-yl-hept-3-enoic acid Openeye Name: (E)-4-(2-acetoxyethyl)-2-formamido-5-isopropyl-6-methyl-5-phosphono-hept-3-enoic acid CAS Name: (E)-4-(2-acetyloxyethyl)-2-formamido-6-methyl-5-phosphono-5-propan-2-yl-3-heptenoic acid IUPAC Name: (E)-4-(2-acetyloxyethyl)-2-formamido-6-methyl-5-phosphono-5-propan-2-ylhept-3-enoic acid Traditional Name: (E)-4-(2-acetoxyethyl)-2-formamido-5-isopropyl-6-methyl-5-phosphono-hept-3-enoic acid Formula: C16H28NO8P MolecularWeight: 393.369181

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)C)(C(=CC(C(=O)O)NC=O)CCOC(=O)C)P(=O)(O)O

Isomeric SMILES

CC(C)C(C(C)C)(/C(=C/C(C(=O)O)NC=O)/CCOC(=O)C)P(=O)(O)O

InChI

InChI=1S/C16H28NO8P/c1-10(2)16(11(3)4,26(22,23)24)13(6-7-25-12(5)19)8-14(15(20)21)17-9-18/h8-11,14H,6-7H2,1-5H3,(H,17,18)(H,20,21)(H2,22,23,24)/b13-8+