5-azanyl-4-(2,5-dimethylphenyl)-6-nitro-3-piperazin-1-yl-1,2,3,4-tetrahydronaphthalen-2-ol

Systemtic Name: 5-azanyl-4-(2,5-dimethylphenyl)-6-nitro-3-piperazin-1-yl-1,2,3,4-tetrahydronaphthalen-2-ol Openeye Name: 5-amino-4-(2,5-dimethylphenyl)-6-nitro-3-piperazin-1-yl-tetralin-2-ol CAS Name: 5-amino-4-(2,5-dimethylphenyl)-6-nitro-3-(1-piperazinyl)-1,2,3,4-tetrahydronaphthalen-2-ol IUPAC Name: 5-amino-4-(2,5-dimethylphenyl)-6-nitro-3-piperazin-1-yl-1,2,3,4-tetrahydronaphthalen-2-ol Traditional Name: 5-amino-4-(2,5-dimethylphenyl)-6-nitro-3-piperazino-tetralin-2-ol Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N4O3/c1-13-3-4-14(2)16(11-13)20-19-15(5-6-17(21(19)23)26(28)29)12-18(27)22(20)25-9-7-24-8-10-25/h3-6,11,18,20,22,24,27H,7-10,12,23H2,1-2H3