7-[[3,5-bis(bromanyl)phenyl]methoxy]-8-piperazin-1-yl-5,6,7,8-tetrahydronaphthalene-2-carbonitrile

Systemtic Name: 7-[[3,5-bis(bromanyl)phenyl]methoxy]-8-piperazin-1-yl-5,6,7,8-tetrahydronaphthalene-2-carbonitrile Openeye Name: 3-[(3,5-dibromophenyl)methoxy]-4-piperazin-1-yl-tetralin-6-carbonitrile CAS Name: 7-[(3,5-dibromophenyl)methoxy]-8-(1-piperazinyl)-5,6,7,8-tetrahydronaphthalene-2-carbonitrile IUPAC Name: 7-[(3,5-dibromophenyl)methoxy]-8-piperazin-1-yl-5,6,7,8-tetrahydronaphthalene-2-carbonitrile Traditional Name: 3-(3,5-dibromobenzyl)oxy-4-piperazino-tetralin-6-carbonitrile Formula: C22H23Br2N3O MolecularWeight: 505.24552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(C=C2)C#N)C(C1OCC3=CC(=CC(=C3)Br)Br)N4CCNCC4

Isomeric SMILES

C1CC2=C(C=C(C=C2)C#N)C(C1OCC3=CC(=CC(=C3)Br)Br)N4CCNCC4

InChI

InChI=1S/C22H23Br2N3O/c23-18-9-16(10-19(24)12-18)14-28-21-4-3-17-2-1-15(13-25)11-20(17)22(21)27-7-5-26-6-8-27/h1-2,9-12,21-22,26H,3-8,14H2