1-(7-chloranyl-5-nitro-1,2,3,4-tetrahydroxanthen-4a-yl)-4-phenyl-piperazine

Systemtic Name: 1-(7-chloranyl-5-nitro-1,2,3,4-tetrahydroxanthen-4a-yl)-4-phenyl-piperazine Openeye Name: 1-(7-chloro-5-nitro-1,2,3,4-tetrahydroxanthen-4a-yl)-4-phenyl-piperazine CAS Name: 1-(7-chloro-5-nitro-1,2,3,4-tetrahydroxanthen-4a-yl)-4-phenylpiperazine IUPAC Name: 1-(7-chloro-5-nitro-1,2,3,4-tetrahydroxanthen-4a-yl)-4-phenylpiperazine Traditional Name: 1-(7-chloro-5-nitro-1,2,3,4-tetrahydroxanthen-4a-yl)-4-phenyl-piperazine Formula: C23H24ClN3O3 MolecularWeight: 425.90796

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C(=CC3=CC(=CC(=C3O2)[N+](=O)[O-])Cl)C1)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CCC2(C(=CC3=CC(=CC(=C3O2)[N+](=O)[O-])Cl)C1)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C23H24ClN3O3/c24-19-15-17-14-18-6-4-5-9-23(18,30-22(17)21(16-19)27(28)29)26-12-10-25(11-13-26)20-7-2-1-3-8-20/h1-3,7-8,14-16H,4-6,9-13H2