4-[(E)-2-(2,6-dimethylphenyl)ethenyl]azepane

Systemtic Name: 4-[(E)-2-(2,6-dimethylphenyl)ethenyl]azepane Openeye Name: 4-[(E)-2-(2,6-dimethylphenyl)vinyl]azepane CAS Name: 4-[(E)-2-(2,6-dimethylphenyl)ethenyl]azepane IUPAC Name: 4-[(E)-2-(2,6-dimethylphenyl)ethenyl]azepane Traditional Name: 4-[(E)-2-(2,6-dimethylphenyl)vinyl]azepane Formula: C16H23N MolecularWeight: 229.36052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C=CC2CCCNCC2

Isomeric SMILES

CC1=C(C(=CC=C1)C)/C=C/C2CCCNCC2

InChI

InChI=1S/C16H23N/c1-13-5-3-6-14(2)16(13)9-8-15-7-4-11-17-12-10-15/h3,5-6,8-9,15,17H,4,7,10-12H2,1-2H3/b9-8+