methyl (2S,3R)-2-azanyl-3-[4-methoxy-3-(3-methylbut-2-enyl)phenyl]-3-oxidanyl-propanoate

Systemtic Name: methyl (2S,3R)-2-azanyl-3-[4-methoxy-3-(3-methylbut-2-enyl)phenyl]-3-oxidanyl-propanoate Openeye Name: methyl (2S,3R)-2-amino-3-hydroxy-3-[4-methoxy-3-(3-methylbut-2-enyl)phenyl]propanoate CAS Name: (2S,3R)-2-amino-3-hydroxy-3-[4-methoxy-3-(3-methylbut-2-enyl)phenyl]propanoic acid methyl ester IUPAC Name: methyl (2S,3R)-2-amino-3-hydroxy-3-[4-methoxy-3-(3-methylbut-2-enyl)phenyl]propanoate Traditional Name: (2S,3R)-2-amino-3-hydroxy-3-[4-methoxy-3-(3-methylbut-2-enyl)phenyl]propionic acid methyl ester Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1=C(C=CC(=C1)C(C(C(=O)OC)N)O)OC)C

Isomeric SMILES

CC(=CCC1=C(C=CC(=C1)[C@H]([C@@H](C(=O)OC)N)O)OC)C

InChI

InChI=1S/C16H23NO4/c1-10(2)5-6-11-9-12(7-8-13(11)20-3)15(18)14(17)16(19)21-4/h5,7-9,14-15,18H,6,17H2,1-4H3/t14-,15+/m0/s1