(E)-3-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[4-(isopropylcarbamoylamino)phenyl]prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[4-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[4-(isopropylcarbamoylamino)phenyl]acrylamide Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=C(C=C1)NC(=O)C=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)NC(=O)NC1=CC=C(C=C1)NC(=O)/C=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H21N3O4/c1-13(2)21-20(25)23-16-7-5-15(6-8-16)22-19(24)10-4-14-3-9-17-18(11-14)27-12-26-17/h3-11,13H,12H2,1-2H3,(H,22,24)(H2,21,23,25)/b10-4+