[(3S)-6-methylhepta-1,6-dien-3-yl] (2S)-2-(ethoxycarbonylamino)-3-phenyl-propanoate

Systemtic Name: [(3S)-6-methylhepta-1,6-dien-3-yl] (2S)-2-(ethoxycarbonylamino)-3-phenyl-propanoate Openeye Name: [(1S)-4-methyl-1-vinyl-pent-4-enyl] (2S)-2-(ethoxycarbonylamino)-3-phenyl-propanoate CAS Name: (2S)-2-(ethoxycarbonylamino)-3-phenylpropanoic acid [(3S)-6-methylhepta-1,6-dien-3-yl] ester IUPAC Name: [(3S)-6-methylhepta-1,6-dien-3-yl] (2S)-2-(ethoxycarbonylamino)-3-phenylpropanoate Traditional Name: (2S)-2-(carbethoxyamino)-3-phenyl-propionic acid [(1S)-4-methyl-1-vinyl-pent-4-enyl] ester Formula: C20H27NO4 MolecularWeight: 345.43268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(CC1=CC=CC=C1)C(=O)OC(CCC(=C)C)C=C

Isomeric SMILES

CCOC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O[C@@H](CCC(=C)C)C=C

InChI

InChI=1S/C20H27NO4/c1-5-17(13-12-15(3)4)25-19(22)18(21-20(23)24-6-2)14-16-10-8-7-9-11-16/h5,7-11,17-18H,1,3,6,12-14H2,2,4H3,(H,21,23)/t17-,18+/m1/s1