[5-(5-bromanyl-2-oxidanyl-phenyl)carbonyl-3-(cyclohexylcarbamoyl)pyran-2-ylidene]azanium

Systemtic Name: [5-(5-bromanyl-2-oxidanyl-phenyl)carbonyl-3-(cyclohexylcarbamoyl)pyran-2-ylidene]azanium Openeye Name: [5-(5-bromo-2-hydroxy-benzoyl)-3-(cyclohexylcarbamoyl)pyran-2-ylidene]ammonium CAS Name: [5-[(5-bromo-2-hydroxyphenyl)-oxomethyl]-3-[(cyclohexylamino)-oxomethyl]-2-pyranylidene]ammonium IUPAC Name: [5-(5-bromo-2-hydroxybenzoyl)-3-(cyclohexylcarbamoyl)pyran-2-ylidene]azanium Traditional Name: [5-(5-bromo-2-hydroxy-benzoyl)-3-(cyclohexylcarbamoyl)pyran-2-ylidene]ammonium Formula: C19H20BrN2O4+ MolecularWeight: 420.2771

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC(=COC2=[NH2+])C(=O)C3=C(C=CC(=C3)Br)O

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC(=COC2=[NH2+])C(=O)C3=C(C=CC(=C3)Br)O

InChI

InChI=1S/C19H19BrN2O4/c20-12-6-7-16(23)14(9-12)17(24)11-8-15(18(21)26-10-11)19(25)22-13-4-2-1-3-5-13/h6-10,13,21,23H,1-5H2,(H,22,25)/p+1