5-(azepan-1-yl)-2-[(E)-2-(4-ethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(azepan-1-yl)-2-[(E)-2-(4-ethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile Openeye Name: 5-(azepan-1-yl)-2-[(E)-2-(4-ethoxyphenyl)vinyl]oxazole-4-carbonitrile CAS Name: 5-(1-azepanyl)-2-[(E)-2-(4-ethoxyphenyl)ethenyl]-4-oxazolecarbonitrile IUPAC Name: 5-(azepan-1-yl)-2-[(E)-2-(4-ethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile Traditional Name: 5-(azepan-1-yl)-2-[(E)-2-p-phenetylvinyl]oxazole-4-carbonitrile Formula: C20H23N3O2 MolecularWeight: 337.41552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC2=NC(=C(O2)N3CCCCCC3)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C2=NC(=C(O2)N3CCCCCC3)C#N

InChI

InChI=1S/C20H23N3O2/c1-2-24-17-10-7-16(8-11-17)9-12-19-22-18(15-21)20(25-19)23-13-5-3-4-6-14-23/h7-12H,2-6,13-14H2,1H3/b12-9+