1-chloranyl-3-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Systemtic Name: 1-chloranyl-3-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Openeye Name: 1-chloro-3-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS Name: 1-chloro-3-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile IUPAC Name: 1-chloro-3-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Traditional Name: 1-chloro-3-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Formula: C16H13ClN2 MolecularWeight: 268.74082

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(N=C(C(=C2C1)C#N)C3=CC=CC=C3)Cl

Isomeric SMILES

C1CCC2=C(N=C(C(=C2C1)C#N)C3=CC=CC=C3)Cl

InChI

InChI=1S/C16H13ClN2/c17-16-13-9-5-4-8-12(13)14(10-18)15(19-16)11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-9H2