ethyl 4-(6-bromanyl-1,3-benzodioxol-5-yl)-2-methylidene-6-oxidanylidene-piperidine-3-carboxylate

Systemtic Name: ethyl 4-(6-bromanyl-1,3-benzodioxol-5-yl)-2-methylidene-6-oxidanylidene-piperidine-3-carboxylate Openeye Name: ethyl 4-(6-bromo-1,3-benzodioxol-5-yl)-2-methylene-6-oxo-piperidine-3-carboxylate CAS Name: 4-(6-bromo-1,3-benzodioxol-5-yl)-2-methylene-6-oxo-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(6-bromo-1,3-benzodioxol-5-yl)-2-methylidene-6-oxopiperidine-3-carboxylate Traditional Name: 4-(6-bromo-1,3-benzodioxol-5-yl)-6-keto-2-methylene-nipecotic acid ethyl ester Formula: C16H16BrNO5 MolecularWeight: 382.20594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC(=O)NC1=C)C2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CCOC(=O)C1C(CC(=O)NC1=C)C2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C16H16BrNO5/c1-3-21-16(20)15-8(2)18-14(19)5-10(15)9-4-12-13(6-11(9)17)23-7-22-12/h4,6,10,15H,2-3,5,7H2,1H3,(H,18,19)