(phenylmethyl) N-[(E,2S)-6-(hydroxymethyl)-3-oxidanylidene-1,7-diphenyl-hept-4-en-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(E,2S)-6-(hydroxymethyl)-3-oxidanylidene-1,7-diphenyl-hept-4-en-2-yl]carbamate Openeye Name: benzyl N-[(E,1S)-1,5-dibenzyl-6-hydroxy-2-oxo-hex-3-enyl]carbamate CAS Name: N-[(E,2S)-6-(hydroxymethyl)-3-oxo-1,7-diphenylhept-4-en-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(E,2S)-6-benzyl-7-hydroxy-3-oxo-1-phenylhept-4-en-2-yl]carbamate Traditional Name: N-[(E,1S)-1,5-dibenzyl-6-hydroxy-2-keto-hex-3-enyl]carbamic acid benzyl ester Formula: C28H29NO4 MolecularWeight: 443.53416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CO)C=CC(=O)C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)/C=C/C(CC2=CC=CC=C2)CO)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C28H29NO4/c30-20-25(18-22-10-4-1-5-11-22)16-17-27(31)26(19-23-12-6-2-7-13-23)29-28(32)33-21-24-14-8-3-9-15-24/h1-17,25-26,30H,18-21H2,(H,29,32)/b17-16+/t25?,26-/m0/s1