N-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-3-methyl-benzamide

Systemtic Name: N-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-3-methyl-benzamide Openeye Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-3-methyl-benzamide CAS Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-3-methylbenzamide IUPAC Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-3-methylbenzamide Traditional Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-3-methyl-benzamide Formula: C16H13BrN2O3 MolecularWeight: 361.19002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NN=CC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N/N=C/C2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C16H13BrN2O3/c1-10-3-2-4-11(5-10)16(20)19-18-8-12-6-14-15(7-13(12)17)22-9-21-14/h2-8H,9H2,1H3,(H,19,20)/b18-8+