N-[3-[2-(methylamino)-2-oxidanylidene-ethoxy]phenyl]-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[3-[2-(methylamino)-2-oxidanylidene-ethoxy]phenyl]-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[3-[2-(methylamino)-2-oxo-ethoxy]phenyl]-4-(3-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]-4-(3-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]-4-(3-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[3-[2-keto-2-(methylamino)ethoxy]phenyl]-4-(3-methylpiperidino)-3-nitro-benzamide Formula: C22H26N4O5 MolecularWeight: 426.46564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O5/c1-15-5-4-10-25(13-15)19-9-8-16(11-20(19)26(29)30)22(28)24-17-6-3-7-18(12-17)31-14-21(27)23-2/h3,6-9,11-12,15H,4-5,10,13-14H2,1-2H3,(H,23,27)(H,24,28)