3-(1,3-benzodioxol-5-yl)-N-(4-methyl-3-nitro-phenyl)propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-(4-methyl-3-nitro-phenyl)propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-(4-methyl-3-nitro-phenyl)propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-(4-methyl-3-nitrophenyl)propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-(4-methyl-3-nitrophenyl)propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-(4-methyl-3-nitro-phenyl)propionamide Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O5/c1-11-2-5-13(9-14(11)19(21)22)18-17(20)7-4-12-3-6-15-16(8-12)24-10-23-15/h2-3,5-6,8-9H,4,7,10H2,1H3,(H,18,20)