ethyl (2Z,5S)-5-benzamido-4-oxidanylidene-6-phenyl-2-(phenylmethylidene)hexanoate

Systemtic Name: ethyl (2Z,5S)-5-benzamido-4-oxidanylidene-6-phenyl-2-(phenylmethylidene)hexanoate Openeye Name: ethyl (2Z,5S)-5-benzamido-2-benzylidene-4-oxo-6-phenyl-hexanoate CAS Name: (2Z,5S)-5-benzamido-4-oxo-6-phenyl-2-(phenylmethylene)hexanoic acid ethyl ester IUPAC Name: ethyl (2Z,5S)-5-benzamido-2-benzylidene-4-oxo-6-phenylhexanoate Traditional Name: (Z)-2-[(3S)-3-benzamido-2-keto-4-phenyl-butyl]-3-phenyl-acrylic acid ethyl ester Formula: C28H27NO4 MolecularWeight: 441.51828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC=CC=C1)CC(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)/C(=C\C1=CC=CC=C1)/CC(=O)[C@H](CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C28H27NO4/c1-2-33-28(32)24(18-21-12-6-3-7-13-21)20-26(30)25(19-22-14-8-4-9-15-22)29-27(31)23-16-10-5-11-17-23/h3-18,25H,2,19-20H2,1H3,(H,29,31)/b24-18-/t25-/m0/s1