2-ethyl-5-phenyl-8-pyrrol-1-yl-3,4-dihydro-1H-isoquinoline-7-carbonitrile

Systemtic Name: 2-ethyl-5-phenyl-8-pyrrol-1-yl-3,4-dihydro-1H-isoquinoline-7-carbonitrile Openeye Name: 2-ethyl-5-phenyl-8-pyrrol-1-yl-3,4-dihydro-1H-isoquinoline-7-carbonitrile CAS Name: 2-ethyl-5-phenyl-8-(1-pyrrolyl)-3,4-dihydro-1H-isoquinoline-7-carbonitrile IUPAC Name: 2-ethyl-5-phenyl-8-pyrrol-1-yl-3,4-dihydro-1H-isoquinoline-7-carbonitrile Traditional Name: 2-ethyl-5-phenyl-8-pyrrol-1-yl-3,4-dihydro-1H-isoquinoline-7-carbonitrile Formula: C22H21N3 MolecularWeight: 327.42224

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2=C(C=C(C(=C2C1)N3C=CC=C3)C#N)C4=CC=CC=C4

Isomeric SMILES

CCN1CCC2=C(C=C(C(=C2C1)N3C=CC=C3)C#N)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3/c1-2-24-13-10-19-20(17-8-4-3-5-9-17)14-18(15-23)22(21(19)16-24)25-11-6-7-12-25/h3-9,11-12,14H,2,10,13,16H2,1H3