7-[[(1S)-1-(3,4-dimethoxyphenyl)but-3-enyl]amino]hept-1-en-3-yl methyl carbonate

Systemtic Name: 7-[[(1S)-1-(3,4-dimethoxyphenyl)but-3-enyl]amino]hept-1-en-3-yl methyl carbonate Openeye Name: [5-[[(1S)-1-(3,4-dimethoxyphenyl)but-3-enyl]amino]-1-vinyl-pentyl] methyl carbonate CAS Name: carbonic acid 7-[[(1S)-1-(3,4-dimethoxyphenyl)but-3-enyl]amino]hept-1-en-3-yl methyl ester IUPAC Name: 7-[[(1S)-1-(3,4-dimethoxyphenyl)but-3-enyl]amino]hept-1-en-3-yl methyl carbonate Traditional Name: carbonic acid 1-[4-[[(1S)-1-(3,4-dimethoxyphenyl)but-3-enyl]amino]butyl]allyl methyl ester Formula: C21H31NO5 MolecularWeight: 377.47454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC=C)NCCCCC(C=C)OC(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H](CC=C)NCCCCC(C=C)OC(=O)OC)OC

InChI

InChI=1S/C21H31NO5/c1-6-10-18(16-12-13-19(24-3)20(15-16)25-4)22-14-9-8-11-17(7-2)27-21(23)26-5/h6-7,12-13,15,17-18,22H,1-2,8-11,14H2,3-5H3/t17?,18-/m0/s1