(E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)-N-ethyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]prop-2-enamide

Systemtic Name: (E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)-N-ethyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]prop-2-enamide Openeye Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-N-ethyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]prop-2-enamide CAS Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-N-ethyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-2-propenamide IUPAC Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-N-ethyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]prop-2-enamide Traditional Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-N-ethyl-N-[(4-keto-1H-quinazolin-2-yl)methyl]acrylamide Formula: C21H18ClN3O4 MolecularWeight: 411.83832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C=CC3=CC4=C(C(=C3)Cl)OCO4

Isomeric SMILES

CCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)/C=C/C3=CC4=C(C(=C3)Cl)OCO4

InChI

InChI=1S/C21H18ClN3O4/c1-2-25(11-18-23-16-6-4-3-5-14(16)21(27)24-18)19(26)8-7-13-9-15(22)20-17(10-13)28-12-29-20/h3-10H,2,11-12H2,1H3,(H,23,24,27)/b8-7+