methyl [(3S,4R,7E)-4-(phenylmethoxycarbonylamino)trideca-1,7-dien-3-yl] carbonate

Systemtic Name: methyl [(3S,4R,7E)-4-(phenylmethoxycarbonylamino)trideca-1,7-dien-3-yl] carbonate Openeye Name: [(E,1S,2R)-2-(benzyloxycarbonylamino)-1-vinyl-undec-5-enyl] methyl carbonate CAS Name: carbonic acid methyl [(3S,4R,7E)-4-(phenylmethoxycarbonylamino)trideca-1,7-dien-3-yl] ester IUPAC Name: methyl [(3S,4R,7E)-4-(phenylmethoxycarbonylamino)trideca-1,7-dien-3-yl] carbonate Traditional Name: carbonic acid [(E,1S,2R)-2-(benzyloxycarbonylamino)-1-vinyl-undec-5-enyl] methyl ester Formula: C23H33NO5 MolecularWeight: 403.51182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCCC(C(C=C)OC(=O)OC)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCC/C=C/CC[C@H]([C@H](C=C)OC(=O)OC)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C23H33NO5/c1-4-6-7-8-9-10-14-17-20(21(5-2)29-23(26)27-3)24-22(25)28-18-19-15-12-11-13-16-19/h5,9-13,15-16,20-21H,2,4,6-8,14,17-18H2,1,3H3,(H,24,25)/b10-9+/t20-,21+/m1/s1