4-azanyl-N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]benzamide

Systemtic Name: 4-azanyl-N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]benzamide Openeye Name: 4-amino-N-[(E)-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]amino]benzamide CAS Name: 4-amino-N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]benzamide IUPAC Name: 4-amino-N-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]benzamide Traditional Name: 4-amino-N-[(E)-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]amino]benzamide Formula: C18H19N3O3 MolecularWeight: 325.36176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=C(C=C1)N)CCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=C(C=C1)N)/CCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H19N3O3/c1-12(20-21-18(22)14-5-7-15(19)8-6-14)2-3-13-4-9-16-17(10-13)24-11-23-16/h4-10H,2-3,11,19H2,1H3,(H,21,22)/b20-12+