3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(4-methyl-3-nitro-phenyl)propanamide

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(4-methyl-3-nitro-phenyl)propanamide Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(4-methyl-3-nitro-phenyl)propanamide CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(4-methyl-3-nitrophenyl)propanamide IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(4-methyl-3-nitrophenyl)propanamide Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(4-methyl-3-nitro-phenyl)propionamide Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCC2=CC3=C(C=C2)OCCO3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCC2=CC3=C(C=C2)OCCO3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O5/c1-12-2-5-14(11-15(12)20(22)23)19-18(21)7-4-13-3-6-16-17(10-13)25-9-8-24-16/h2-3,5-6,10-11H,4,7-9H2,1H3,(H,19,21)