6-nitro-3-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]carbonyl-2,3-dihydroinden-1-one

Systemtic Name: 6-nitro-3-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]carbonyl-2,3-dihydroinden-1-one Openeye Name: 6-nitro-3-[2-(pyrrolidin-1-ylmethyl)piperidine-1-carbonyl]indan-1-one CAS Name: 6-nitro-3-[oxo-[2-(1-pyrrolidinylmethyl)-1-piperidinyl]methyl]-2,3-dihydroinden-1-one IUPAC Name: 6-nitro-3-[2-(pyrrolidin-1-ylmethyl)piperidine-1-carbonyl]-2,3-dihydroinden-1-one Traditional Name: 6-nitro-3-[2-(pyrrolidinomethyl)piperidine-1-carbonyl]indan-1-one Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CN2CCCC2)C(=O)C3CC(=O)C4=C3C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C(C1)CN2CCCC2)C(=O)C3CC(=O)C4=C3C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H25N3O4/c24-19-12-18(16-7-6-14(23(26)27)11-17(16)19)20(25)22-10-2-1-5-15(22)13-21-8-3-4-9-21/h6-7,11,15,18H,1-5,8-10,12-13H2