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

Systemtic Name: N-[[3-(cyclopropylcarbonylamino)phenyl]methyl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[[3-[[cyclopropyl(oxo)methyl]amino]phenyl]methyl]-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[3-(cyclopropanecarbonylamino)benzyl]-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C24H28N4O4 MolecularWeight: 436.50352

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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)C4CC4)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C4CC4)[N+](=O)[O-]

InChI

InChI=1S/C24H28N4O4/c1-16-9-11-27(12-10-16)21-8-7-19(14-22(21)28(31)32)23(29)25-15-17-3-2-4-20(13-17)26-24(30)18-5-6-18/h2-4,7-8,13-14,16,18H,5-6,9-12,15H2,1H3,(H,25,29)(H,26,30)