N-[3-methoxy-4-(2-oxidanylidenepiperidin-1-yl)phenyl]-3-methyl-4-nitro-benzamide

Systemtic Name: N-[3-methoxy-4-(2-oxidanylidenepiperidin-1-yl)phenyl]-3-methyl-4-nitro-benzamide Openeye Name: N-[3-methoxy-4-(2-oxo-1-piperidyl)phenyl]-3-methyl-4-nitro-benzamide CAS Name: N-[3-methoxy-4-(2-oxo-1-piperidinyl)phenyl]-3-methyl-4-nitrobenzamide IUPAC Name: N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-3-methyl-4-nitrobenzamide Traditional Name: N-[4-(2-ketopiperidino)-3-methoxy-phenyl]-3-methyl-4-nitro-benzamide Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=CC(=C(C=C2)N3CCCCC3=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=CC(=C(C=C2)N3CCCCC3=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O5/c1-13-11-14(6-8-16(13)23(26)27)20(25)21-15-7-9-17(18(12-15)28-2)22-10-4-3-5-19(22)24/h6-9,11-12H,3-5,10H2,1-2H3,(H,21,25)