3,4,5-trimethoxy-2-nitro-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]benzamide

Systemtic Name: 3,4,5-trimethoxy-2-nitro-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]benzamide Openeye Name: N-[[4-(isopropylcarbamoylamino)phenyl]methyl]-3,4,5-trimethoxy-2-nitro-benzamide CAS Name: 3,4,5-trimethoxy-2-nitro-N-[[4-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]methyl]benzamide IUPAC Name: 3,4,5-trimethoxy-2-nitro-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]benzamide Traditional Name: N-[4-(isopropylcarbamoylamino)benzyl]-3,4,5-trimethoxy-2-nitro-benzamide Formula: C21H26N4O7 MolecularWeight: 446.45374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C(=C2[N+](=O)[O-])OC)OC)OC

Isomeric SMILES

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C(=C2[N+](=O)[O-])OC)OC)OC

InChI

InChI=1S/C21H26N4O7/c1-12(2)23-21(27)24-14-8-6-13(7-9-14)11-22-20(26)15-10-16(30-3)18(31-4)19(32-5)17(15)25(28)29/h6-10,12H,11H2,1-5H3,(H,22,26)(H2,23,24,27)