N-[2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[2-(2-furyl)-2-pyrrolidin-1-yl-ethyl]-2-methyl-3-nitro-benzamide CAS Name: N-[2-(2-furanyl)-2-(1-pyrrolidinyl)ethyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[2-(2-furyl)-2-pyrrolidino-ethyl]-2-methyl-3-nitro-benzamide Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC(C2=CC=CO2)N3CCCC3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC(C2=CC=CO2)N3CCCC3

InChI

InChI=1S/C18H21N3O4/c1-13-14(6-4-7-15(13)21(23)24)18(22)19-12-16(17-8-5-11-25-17)20-9-2-3-10-20/h4-8,11,16H,2-3,9-10,12H2,1H3,(H,19,22)