2-[4-(2-diethylaminoethyloxy)phenyl]-3,3-diphenyl-prop-2-enenitrile chloride

Systemtic Name: 2-[4-(2-diethylaminoethyloxy)phenyl]-3,3-diphenyl-prop-2-enenitrile chloride Openeye Name: 2-[4-(2-diethylaminoethyloxy)phenyl]-3,3-diphenyl-prop-2-enenitrile chloride CAS Name: 2-[4-(2-diethylaminoethyloxy)phenyl]-3,3-diphenyl-2-propenenitrile chloride IUPAC Name: 2-[4-(2-diethylaminoethyloxy)phenyl]-3,3-diphenylprop-2-enenitrile chloride Traditional Name: 2-[4-(2-diethylaminoethyloxy)phenyl]-3,3-diphenyl-acrylonitrile chloride Formula: C27H28ClN2O- MolecularWeight: 431.97702

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)C3=CC=CC=C3)C#N.[Cl-]

Isomeric SMILES

CCN(CC)CCOC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)C3=CC=CC=C3)C#N.[Cl-]

InChI

InChI=1S/C27H28N2O.ClH/c1-3-29(4-2)19-20-30-25-17-15-22(16-18-25)26(21-28)27(23-11-7-5-8-12-23)24-13-9-6-10-14-24;/h5-18H,3-4,19-20H2,1-2H3;1H/p-1