1-[(4aS)-7-nitro-1,2,3,4-tetrahydroxanthen-4a-yl]piperidine

Systemtic Name: 1-[(4aS)-7-nitro-1,2,3,4-tetrahydroxanthen-4a-yl]piperidine Openeye Name: 1-[(4aS)-7-nitro-1,2,3,4-tetrahydroxanthen-4a-yl]piperidine CAS Name: 1-[(4aS)-7-nitro-1,2,3,4-tetrahydroxanthen-4a-yl]piperidine IUPAC Name: 1-[(4aS)-7-nitro-1,2,3,4-tetrahydroxanthen-4a-yl]piperidine Traditional Name: 1-[(4aS)-7-nitro-1,2,3,4-tetrahydroxanthen-4a-yl]piperidine Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C23CCCCC2=CC4=C(O3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)[C@]23CCCCC2=CC4=C(O3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H22N2O3/c21-20(22)16-7-8-17-14(13-16)12-15-6-2-3-9-18(15,23-17)19-10-4-1-5-11-19/h7-8,12-13H,1-6,9-11H2/t18-/m0/s1