(E,4S,5S)-5-methyl-4-[methyl(phenylmethoxycarbonyl)amino]hept-2-enoic acid

Systemtic Name: (E,4S,5S)-5-methyl-4-[methyl(phenylmethoxycarbonyl)amino]hept-2-enoic acid Openeye Name: (E,4S,5S)-4-[benzyloxycarbonyl(methyl)amino]-5-methyl-hept-2-enoic acid CAS Name: (E,4S,5S)-5-methyl-4-[methyl(phenylmethoxycarbonyl)amino]-2-heptenoic acid IUPAC Name: (E,4S,5S)-5-methyl-4-[methyl(phenylmethoxycarbonyl)amino]hept-2-enoic acid Traditional Name: (E,4S,5S)-4-[carbobenzoxy(methyl)amino]-5-methyl-hept-2-enoic acid Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C=CC(=O)O)N(C)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC[C@H](C)[C@@H](/C=C/C(=O)O)N(C)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H23NO4/c1-4-13(2)15(10-11-16(19)20)18(3)17(21)22-12-14-8-6-5-7-9-14/h5-11,13,15H,4,12H2,1-3H3,(H,19,20)/b11-10+/t13-,15+/m0/s1