3-nitro-N-[(4-propan-2-yloxyphenyl)methyl]benzamide

Systemtic Name: 3-nitro-N-[(4-propan-2-yloxyphenyl)methyl]benzamide Openeye Name: N-[(4-isopropoxyphenyl)methyl]-3-nitro-benzamide CAS Name: 3-nitro-N-[(4-propan-2-yloxyphenyl)methyl]benzamide IUPAC Name: 3-nitro-N-[(4-propan-2-yloxyphenyl)methyl]benzamide Traditional Name: N-(4-isopropoxybenzyl)-3-nitro-benzamide Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O4/c1-12(2)23-16-8-6-13(7-9-16)11-18-17(20)14-4-3-5-15(10-14)19(21)22/h3-10,12H,11H2,1-2H3,(H,18,20)