4-[[2-(2-hydroxyethyloxy)-5-propanoyl-cyclohexa-1,5-dien-1-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[2-(2-hydroxyethyloxy)-5-propanoyl-cyclohexa-1,5-dien-1-yl]amino]benzenecarbonitrile Openeye Name: 4-[[2-(2-hydroxyethoxy)-5-propanoyl-cyclohexa-1,5-dien-1-yl]amino]benzonitrile CAS Name: 4-[[2-(2-hydroxyethoxy)-5-(1-oxopropyl)-1-cyclohexa-1,5-dienyl]amino]benzonitrile IUPAC Name: 4-[[2-(2-hydroxyethoxy)-5-propanoylcyclohexa-1,5-dien-1-yl]amino]benzonitrile Traditional Name: 4-[[2-(2-hydroxyethoxy)-5-propionyl-cyclohexa-1,5-dien-1-yl]amino]benzonitrile Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=C(CC1)OCCO)NC2=CC=C(C=C2)C#N

Isomeric SMILES

CCC(=O)C1=CC(=C(CC1)OCCO)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H20N2O3/c1-2-17(22)14-5-8-18(23-10-9-21)16(11-14)20-15-6-3-13(12-19)4-7-15/h3-4,6-7,11,20-21H,2,5,8-10H2,1H3