8-nitro-3,3-bis(pyrrolidin-1-ylmethyl)-2H-chromen-4-one

Systemtic Name: 8-nitro-3,3-bis(pyrrolidin-1-ylmethyl)-2H-chromen-4-one Openeye Name: 8-nitro-3,3-bis(pyrrolidin-1-ylmethyl)chroman-4-one CAS Name: 8-nitro-3,3-bis(1-pyrrolidinylmethyl)-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 8-nitro-3,3-bis(pyrrolidin-1-ylmethyl)-2H-chromen-4-one Traditional Name: 8-nitro-3,3-bis(pyrrolidinomethyl)chroman-4-one Formula: C19H25N3O4 MolecularWeight: 359.4195

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2(COC3=C(C2=O)C=CC=C3[N+](=O)[O-])CN4CCCC4

Isomeric SMILES

C1CCN(C1)CC2(COC3=C(C2=O)C=CC=C3[N+](=O)[O-])CN4CCCC4

InChI

InChI=1S/C19H25N3O4/c23-18-15-6-5-7-16(22(24)25)17(15)26-14-19(18,12-20-8-1-2-9-20)13-21-10-3-4-11-21/h5-7H,1-4,8-14H2