methyl (2S)-3-oxidanyl-2-[[(E)-3-(3-phenoxyphenyl)prop-2-enyl]amino]propanoate

Systemtic Name: methyl (2S)-3-oxidanyl-2-[[(E)-3-(3-phenoxyphenyl)prop-2-enyl]amino]propanoate Openeye Name: methyl (2S)-3-hydroxy-2-[[(E)-3-(3-phenoxyphenyl)allyl]amino]propanoate CAS Name: (2S)-3-hydroxy-2-[[(E)-3-(3-phenoxyphenyl)prop-2-enyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-hydroxy-2-[[(E)-3-(3-phenoxyphenyl)prop-2-enyl]amino]propanoate Traditional Name: (2S)-3-hydroxy-2-[[(E)-3-(3-phenoxyphenyl)allyl]amino]propionic acid methyl ester Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NCC=CC1=CC(=CC=C1)OC2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@H](CO)NC/C=C/C1=CC(=CC=C1)OC2=CC=CC=C2

InChI

InChI=1S/C19H21NO4/c1-23-19(22)18(14-21)20-12-6-8-15-7-5-11-17(13-15)24-16-9-3-2-4-10-16/h2-11,13,18,20-21H,12,14H2,1H3/b8-6+/t18-/m0/s1