(2S)-2-ethenyl-1-[(4-methoxyphenyl)methyl]azepane

Systemtic Name: (2S)-2-ethenyl-1-[(4-methoxyphenyl)methyl]azepane Openeye Name: (2S)-1-[(4-methoxyphenyl)methyl]-2-vinyl-azepane CAS Name: (2S)-2-ethenyl-1-[(4-methoxyphenyl)methyl]azepane IUPAC Name: (2S)-2-ethenyl-1-[(4-methoxyphenyl)methyl]azepane Traditional Name: (2S)-1-p-anisyl-2-vinyl-azepane Formula: C16H23NO MolecularWeight: 245.35992

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCCCCC2C=C

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCCCC[C@H]2C=C

InChI

InChI=1S/C16H23NO/c1-3-15-7-5-4-6-12-17(15)13-14-8-10-16(18-2)11-9-14/h3,8-11,15H,1,4-7,12-13H2,2H3/t15-/m1/s1