N-[(E)-3-azanyl-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-prop-1-en-2-yl]-3-methyl-benzamide

Systemtic Name: N-[(E)-3-azanyl-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-prop-1-en-2-yl]-3-methyl-benzamide Openeye Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-carbamoyl-vinyl]-3-methyl-benzamide CAS Name: N-[(E)-3-amino-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]-3-methylbenzamide IUPAC Name: N-[(E)-3-amino-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]-3-methylbenzamide Traditional Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-carbamoyl-vinyl]-3-methyl-benzamide Formula: C18H16N2O4 MolecularWeight: 324.33064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(=CC2=CC3=C(C=C2)OCO3)C(=O)N

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N/C(=C/C2=CC3=C(C=C2)OCO3)/C(=O)N

InChI

InChI=1S/C18H16N2O4/c1-11-3-2-4-13(7-11)18(22)20-14(17(19)21)8-12-5-6-15-16(9-12)24-10-23-15/h2-9H,10H2,1H3,(H2,19,21)(H,20,22)/b14-8+