6-bromanyl-2-oxidanylidene-N-(2-piperidin-1-ium-1-ylethyl)chromene-3-carboxamide

Systemtic Name: 6-bromanyl-2-oxidanylidene-N-(2-piperidin-1-ium-1-ylethyl)chromene-3-carboxamide Openeye Name: 6-bromo-2-oxo-N-(2-piperidin-1-ium-1-ylethyl)chromene-3-carboxamide CAS Name: 6-bromo-2-oxo-N-[2-(1-piperidin-1-iumyl)ethyl]-1-benzopyran-3-carboxamide IUPAC Name: 6-bromo-2-oxo-N-(2-piperidin-1-ium-1-ylethyl)chromene-3-carboxamide Traditional Name: 6-bromo-2-keto-N-(2-piperidin-1-ium-1-ylethyl)chromene-3-carboxamide Formula: C17H20BrN2O3+ MolecularWeight: 380.2563

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCNC(=O)C2=CC3=C(C=CC(=C3)Br)OC2=O

Isomeric SMILES

C1CC[NH+](CC1)CCNC(=O)C2=CC3=C(C=CC(=C3)Br)OC2=O

InChI

InChI=1S/C17H19BrN2O3/c18-13-4-5-15-12(10-13)11-14(17(22)23-15)16(21)19-6-9-20-7-2-1-3-8-20/h4-5,10-11H,1-3,6-9H2,(H,19,21)/p+1