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

Systemtic Name: N-[[3-(cyclobutylcarbonylamino)phenyl]methyl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[[3-(cyclobutanecarbonylamino)phenyl]methyl]-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[[3-[[cyclobutyl(oxo)methyl]amino]phenyl]methyl]-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[[3-(cyclobutanecarbonylamino)phenyl]methyl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[3-(cyclobutanecarbonylamino)benzyl]-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C25H30N4O4 MolecularWeight: 450.5301

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C4CCC4)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C4CCC4)[N+](=O)[O-]

InChI

InChI=1S/C25H30N4O4/c1-17-10-12-28(13-11-17)22-9-8-20(15-23(22)29(32)33)24(30)26-16-18-4-2-7-21(14-18)27-25(31)19-5-3-6-19/h2,4,7-9,14-15,17,19H,3,5-6,10-13,16H2,1H3,(H,26,30)(H,27,31)