6-[(E)-2-[4-ethyl-2-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-6-yl]ethenyl]naphthalene-2-carbonitrile

Systemtic Name: 6-[(E)-2-[4-ethyl-2-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-6-yl]ethenyl]naphthalene-2-carbonitrile Openeye Name: 6-[(E)-2-(2-benzyl-4-ethyl-3,4-dihydro-1H-isoquinolin-6-yl)vinyl]naphthalene-2-carbonitrile CAS Name: 6-[(E)-2-[4-ethyl-2-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-6-yl]ethenyl]-2-naphthalenecarbonitrile IUPAC Name: 6-[(E)-2-(2-benzyl-4-ethyl-3,4-dihydro-1H-isoquinolin-6-yl)ethenyl]naphthalene-2-carbonitrile Traditional Name: 6-[(E)-2-(2-benzyl-4-ethyl-3,4-dihydro-1H-isoquinolin-6-yl)vinyl]naphthalene-2-carbonitrile Formula: C31H28N2 MolecularWeight: 428.56742

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CC2=C1C=C(C=C2)C=CC3=CC4=C(C=C3)C=C(C=C4)C#N)CC5=CC=CC=C5

Isomeric SMILES

CCC1CN(CC2=C1C=C(C=C2)/C=C/C3=CC4=C(C=C3)C=C(C=C4)C#N)CC5=CC=CC=C5

InChI

InChI=1S/C31H28N2/c1-2-27-21-33(20-25-6-4-3-5-7-25)22-30-15-11-24(18-31(27)30)9-8-23-10-13-29-17-26(19-32)12-14-28(29)16-23/h3-18,27H,2,20-22H2,1H3/b9-8+