2-(3-nitrophenyl)-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanone

Systemtic Name: 2-(3-nitrophenyl)-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanone Openeye Name: 2-(3-nitrophenyl)-1-[2-(pyrrolidin-1-ylmethyl)-1-piperidyl]ethanone CAS Name: 2-(3-nitrophenyl)-1-[2-(1-pyrrolidinylmethyl)-1-piperidinyl]ethanone IUPAC Name: 2-(3-nitrophenyl)-1-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanone Traditional Name: 2-(3-nitrophenyl)-1-[2-(pyrrolidinomethyl)piperidino]ethanone Formula: C18H25N3O3 MolecularWeight: 331.4094

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CN2CCCC2)C(=O)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C(C1)CN2CCCC2)C(=O)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H25N3O3/c22-18(13-15-6-5-8-16(12-15)21(23)24)20-11-2-1-7-17(20)14-19-9-3-4-10-19/h5-6,8,12,17H,1-4,7,9-11,13-14H2