N-[[1-(furan-2-ylmethyl)piperidin-4-yl]methyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[[1-(furan-2-ylmethyl)piperidin-4-yl]methyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[[1-(2-furylmethyl)-4-piperidyl]methyl]-4-methyl-3-nitro-benzamide CAS Name: N-[[1-(2-furanylmethyl)-4-piperidinyl]methyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[[1-(furan-2-ylmethyl)piperidin-4-yl]methyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[[1-(2-furfuryl)-4-piperidyl]methyl]-4-methyl-3-nitro-benzamide Formula: C19H23N3O4 MolecularWeight: 357.40362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC2CCN(CC2)CC3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC2CCN(CC2)CC3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O4/c1-14-4-5-16(11-18(14)22(24)25)19(23)20-12-15-6-8-21(9-7-15)13-17-3-2-10-26-17/h2-5,10-11,15H,6-9,12-13H2,1H3,(H,20,23)