(E)-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(3-nitrophenyl)-N-propyl-prop-2-enamide

Systemtic Name: (E)-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(3-nitrophenyl)-N-propyl-prop-2-enamide Openeye Name: (E)-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(3-nitrophenyl)-N-propyl-prop-2-enamide CAS Name: (E)-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(3-nitrophenyl)-N-propyl-2-propenamide IUPAC Name: (E)-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(3-nitrophenyl)-N-propylprop-2-enamide Traditional Name: (E)-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(3-nitrophenyl)-N-propyl-acrylamide Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1COC2=CC=CC=C2O1)C(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCN(CC1COC2=CC=CC=C2O1)C(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H22N2O5/c1-2-12-22(14-18-15-27-19-8-3-4-9-20(19)28-18)21(24)11-10-16-6-5-7-17(13-16)23(25)26/h3-11,13,18H,2,12,14-15H2,1H3/b11-10+