N-[4-(furan-2-yl)butan-2-yl]-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[4-(furan-2-yl)butan-2-yl]-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[3-(2-furyl)-1-methyl-propyl]-4-(3-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[4-(2-furanyl)butan-2-yl]-4-(3-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[4-(furan-2-yl)butan-2-yl]-4-(3-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[3-(2-furyl)-1-methyl-propyl]-4-(3-methylpiperidino)-3-nitro-benzamide Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC(C)CCC3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC(C)CCC3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C21H27N3O4/c1-15-5-3-11-23(14-15)19-10-8-17(13-20(19)24(26)27)21(25)22-16(2)7-9-18-6-4-12-28-18/h4,6,8,10,12-13,15-16H,3,5,7,9,11,14H2,1-2H3,(H,22,25)