[[(E,3S)-1-oxidanylidenenon-6-en-3-yl]-phenylmethoxycarbonyl-amino] (phenylmethyl) carbonate

Systemtic Name: [[(E,3S)-1-oxidanylidenenon-6-en-3-yl]-phenylmethoxycarbonyl-amino] (phenylmethyl) carbonate Openeye Name: benzyl [benzyloxycarbonyl-[(E,1S)-1-(2-oxoethyl)hept-4-enyl]amino] carbonate CAS Name: carbonic acid [[(E,3S)-1-oxonon-6-en-3-yl]-phenylmethoxycarbonylamino] (phenylmethyl) ester IUPAC Name: benzyl [[(E,3S)-1-oxonon-6-en-3-yl]-phenylmethoxycarbonylamino] carbonate Traditional Name: carbonic acid benzyl [carbobenzoxy-[(E,1S)-1-(2-ketoethyl)hept-4-enyl]amino] ester Formula: C25H29NO6 MolecularWeight: 439.50086

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCCC(CC=O)N(C(=O)OCC1=CC=CC=C1)OC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC/C=C/CC[C@@H](CC=O)N(C(=O)OCC1=CC=CC=C1)OC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C25H29NO6/c1-2-3-4-11-16-23(17-18-27)26(24(28)30-19-21-12-7-5-8-13-21)32-25(29)31-20-22-14-9-6-10-15-22/h3-10,12-15,18,23H,2,11,16-17,19-20H2,1H3/b4-3+/t23-/m0/s1