(2R)-2-[[(Z)-2-cyano-3-(4-methoxy-2-oxidanyl-phenyl)prop-2-enoyl]amino]-3-methyl-butanoate

Systemtic Name: (2R)-2-[[(Z)-2-cyano-3-(4-methoxy-2-oxidanyl-phenyl)prop-2-enoyl]amino]-3-methyl-butanoate Openeye Name: (2R)-2-[[(Z)-2-cyano-3-(2-hydroxy-4-methoxy-phenyl)prop-2-enoyl]amino]-3-methyl-butanoate CAS Name: (2R)-2-[[(Z)-2-cyano-3-(2-hydroxy-4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-3-methylbutanoate IUPAC Name: (2R)-2-[[(Z)-2-cyano-3-(2-hydroxy-4-methoxyphenyl)prop-2-enoyl]amino]-3-methylbutanoate Traditional Name: (2R)-2-[[(Z)-2-cyano-3-(2-hydroxy-4-methoxy-phenyl)acryloyl]amino]-3-methyl-butyrate Formula: C16H17N2O5- MolecularWeight: 317.31658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC(=O)C(=CC1=C(C=C(C=C1)OC)O)C#N

Isomeric SMILES

CC(C)[C@H](C(=O)[O-])NC(=O)/C(=C\C1=C(C=C(C=C1)OC)O)/C#N

InChI

InChI=1S/C16H18N2O5/c1-9(2)14(16(21)22)18-15(20)11(8-17)6-10-4-5-12(23-3)7-13(10)19/h4-7,9,14,19H,1-3H3,(H,18,20)(H,21,22)/p-1/b11-6-/t14-/m1/s1