methyl 8-chloranyl-2-ethenyl-3-(phenylmethoxycarbonylamino)octanoate

Systemtic Name: methyl 8-chloranyl-2-ethenyl-3-(phenylmethoxycarbonylamino)octanoate Openeye Name: methyl 3-(benzyloxycarbonylamino)-8-chloro-2-vinyl-octanoate CAS Name: 8-chloro-2-ethenyl-3-(phenylmethoxycarbonylamino)octanoic acid methyl ester IUPAC Name: methyl 8-chloro-2-ethenyl-3-(phenylmethoxycarbonylamino)octanoate Traditional Name: 2-[1-(benzyloxycarbonylamino)-6-chloro-hexyl]but-3-enoic acid methyl ester Formula: C19H26ClNO4 MolecularWeight: 367.86704

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C=C)C(CCCCCCl)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

COC(=O)C(C=C)C(CCCCCCl)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C19H26ClNO4/c1-3-16(18(22)24-2)17(12-8-5-9-13-20)21-19(23)25-14-15-10-6-4-7-11-15/h3-4,6-7,10-11,16-17H,1,5,8-9,12-14H2,2H3,(H,21,23)