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

Systemtic Name: N-[[3-(cyclobutylcarbonylamino)phenyl]methyl]-3,4,5-trimethoxy-2-nitro-benzamide Openeye Name: N-[[3-(cyclobutanecarbonylamino)phenyl]methyl]-3,4,5-trimethoxy-2-nitro-benzamide CAS Name: N-[[3-[[cyclobutyl(oxo)methyl]amino]phenyl]methyl]-3,4,5-trimethoxy-2-nitrobenzamide IUPAC Name: N-[[3-(cyclobutanecarbonylamino)phenyl]methyl]-3,4,5-trimethoxy-2-nitrobenzamide Traditional Name: N-[3-(cyclobutanecarbonylamino)benzyl]-3,4,5-trimethoxy-2-nitro-benzamide Formula: C22H25N3O7 MolecularWeight: 443.4498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)NCC2=CC(=CC=C2)NC(=O)C3CCC3)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)NCC2=CC(=CC=C2)NC(=O)C3CCC3)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C22H25N3O7/c1-30-17-11-16(18(25(28)29)20(32-3)19(17)31-2)22(27)23-12-13-6-4-9-15(10-13)24-21(26)14-7-5-8-14/h4,6,9-11,14H,5,7-8,12H2,1-3H3,(H,23,27)(H,24,26)