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

Systemtic Name: (3R)-4-[[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]amino]-3-phenyl-butanoate Openeye Name: (3R)-4-[[(E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoyl]amino]-3-phenyl-butanoate CAS Name: (3R)-4-[[(E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxoprop-2-enyl]amino]-3-phenylbutanoate IUPAC Name: (3R)-4-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino]-3-phenylbutanoate Traditional Name: (3R)-4-[[(E)-3-(4-hydroxy-3-methoxy-phenyl)acryloyl]amino]-3-phenyl-butyrate Formula: C20H20NO5- MolecularWeight: 354.3765

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)NCC(CC(=O)[O-])C2=CC=CC=C2)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)NC[C@H](CC(=O)[O-])C2=CC=CC=C2)O

InChI

InChI=1S/C20H21NO5/c1-26-18-11-14(7-9-17(18)22)8-10-19(23)21-13-16(12-20(24)25)15-5-3-2-4-6-15/h2-11,16,22H,12-13H2,1H3,(H,21,23)(H,24,25)/p-1/b10-8+/t16-/m0/s1