[(1S)-1-cyanoethyl] 3-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]propanoate

Systemtic Name: [(1S)-1-cyanoethyl] 3-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]propanoate Openeye Name: [(1S)-1-cyanoethyl] 3-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]propanoate CAS Name: 3-[[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]propanoic acid [(1S)-1-cyanoethyl] ester IUPAC Name: [(1S)-1-cyanoethyl] 3-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]propanoate Traditional Name: 3-[[(E)-3-(4-methoxyphenyl)acryloyl]amino]propionic acid [(1S)-1-cyanoethyl] ester Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)CCNC(=O)C=CC1=CC=C(C=C1)OC

Isomeric SMILES

C[C@@H](C#N)OC(=O)CCNC(=O)/C=C/C1=CC=C(C=C1)OC

InChI

InChI=1S/C16H18N2O4/c1-12(11-17)22-16(20)9-10-18-15(19)8-5-13-3-6-14(21-2)7-4-13/h3-8,12H,9-10H2,1-2H3,(H,18,19)/b8-5+/t12-/m0/s1