3-nitro-4-piperidin-1-yl-thiochromen-2-one

Systemtic Name: 3-nitro-4-piperidin-1-yl-thiochromen-2-one Openeye Name: 3-nitro-4-(1-piperidyl)thiochromen-2-one CAS Name: 3-nitro-4-(1-piperidinyl)-1-benzothiopyran-2-one IUPAC Name: 3-nitro-4-piperidin-1-ylthiochromen-2-one Traditional Name: 3-nitro-4-piperidino-thiochromen-2-one Formula: C14H14N2O3S MolecularWeight: 290.33756

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=O)SC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C(=O)SC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C14H14N2O3S/c17-14-13(16(18)19)12(15-8-4-1-5-9-15)10-6-2-3-7-11(10)20-14/h2-3,6-7H,1,4-5,8-9H2