1-[(3S,4R)-2,2-dimethyl-6-nitro-3-oxidanyl-3,4-dihydrobenzo[h]chromen-4-yl]piperidin-2-one

Systemtic Name: 1-[(3S,4R)-2,2-dimethyl-6-nitro-3-oxidanyl-3,4-dihydrobenzo[h]chromen-4-yl]piperidin-2-one Openeye Name: 1-[(3S,4R)-3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydrobenzo[h]chromen-4-yl]piperidin-2-one CAS Name: 1-[(3S,4R)-3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydrobenzo[h][1]benzopyran-4-yl]-2-piperidinone IUPAC Name: 1-[(3S,4R)-3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydrobenzo[h]chromen-4-yl]piperidin-2-one Traditional Name: 1-[(3S,4R)-3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydrobenzo[h]chromen-4-yl]-2-piperidone Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C3=CC=CC=C3C(=C2)[N+](=O)[O-])N4CCCCC4=O)O)C

Isomeric SMILES

CC1([C@H]([C@@H](C2=C(O1)C3=CC=CC=C3C(=C2)[N+](=O)[O-])N4CCCCC4=O)O)C

InChI

InChI=1S/C20H22N2O5/c1-20(2)19(24)17(21-10-6-5-9-16(21)23)14-11-15(22(25)26)12-7-3-4-8-13(12)18(14)27-20/h3-4,7-8,11,17,19,24H,5-6,9-10H2,1-2H3/t17-,19+/m1/s1