N-[(3-methoxyphenyl)methyl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[(3-methoxyphenyl)methyl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[(3-methoxyphenyl)methyl]-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[(3-methoxyphenyl)methyl]-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-m-anisyl-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCC3=CC(=CC=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCC3=CC(=CC=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O4/c1-15-8-10-23(11-9-15)19-7-6-17(13-20(19)24(26)27)21(25)22-14-16-4-3-5-18(12-16)28-2/h3-7,12-13,15H,8-11,14H2,1-2H3,(H,22,25)