4-(2,5-dimethylphenyl)-7-nitro-3-piperazin-1-yl-1,2,3,4-tetrahydronaphthalen-2-ol

Systemtic Name: 4-(2,5-dimethylphenyl)-7-nitro-3-piperazin-1-yl-1,2,3,4-tetrahydronaphthalen-2-ol Openeye Name: 4-(2,5-dimethylphenyl)-7-nitro-3-piperazin-1-yl-tetralin-2-ol CAS Name: 4-(2,5-dimethylphenyl)-7-nitro-3-(1-piperazinyl)-1,2,3,4-tetrahydronaphthalen-2-ol IUPAC Name: 4-(2,5-dimethylphenyl)-7-nitro-3-piperazin-1-yl-1,2,3,4-tetrahydronaphthalen-2-ol Traditional Name: 4-(2,5-dimethylphenyl)-7-nitro-3-piperazino-tetralin-2-ol Formula: C22H27N3O3 MolecularWeight: 381.46808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2C(C(CC3=C2C=CC(=C3)[N+](=O)[O-])O)N4CCNCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2C(C(CC3=C2C=CC(=C3)[N+](=O)[O-])O)N4CCNCC4

InChI

InChI=1S/C22H27N3O3/c1-14-3-4-15(2)19(11-14)21-18-6-5-17(25(27)28)12-16(18)13-20(26)22(21)24-9-7-23-8-10-24/h3-6,11-12,20-23,26H,7-10,13H2,1-2H3