N-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[2-(3-fluoroanilino)-2-oxo-ethyl]-N-methyl-4-(3-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[2-(3-fluoroanilino)-2-oxoethyl]-N-methyl-4-(3-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[2-(3-fluoroanilino)-2-oxoethyl]-N-methyl-4-(3-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[2-(3-fluoroanilino)-2-keto-ethyl]-N-methyl-4-(3-methylpiperidino)-3-nitro-benzamide Formula: C22H25FN4O4 MolecularWeight: 428.456703

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)N(C)CC(=O)NC3=CC(=CC=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)N(C)CC(=O)NC3=CC(=CC=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C22H25FN4O4/c1-15-5-4-10-26(13-15)19-9-8-16(11-20(19)27(30)31)22(29)25(2)14-21(28)24-18-7-3-6-17(23)12-18/h3,6-9,11-12,15H,4-5,10,13-14H2,1-2H3,(H,24,28)