2-azanylidene-5-(5-methyl-2-oxidanyl-phenyl)carbonyl-N-(2-morpholin-4-ium-4-ylethyl)pyran-3-carboxamide

Systemtic Name: 2-azanylidene-5-(5-methyl-2-oxidanyl-phenyl)carbonyl-N-(2-morpholin-4-ium-4-ylethyl)pyran-3-carboxamide Openeye Name: 5-(2-hydroxy-5-methyl-benzoyl)-2-imino-N-(2-morpholin-4-ium-4-ylethyl)pyran-3-carboxamide CAS Name: 5-[(2-hydroxy-5-methylphenyl)-oxomethyl]-2-imino-N-[2-(4-morpholin-4-iumyl)ethyl]-3-pyrancarboxamide IUPAC Name: 5-(2-hydroxy-5-methylbenzoyl)-2-imino-N-(2-morpholin-4-ium-4-ylethyl)pyran-3-carboxamide Traditional Name: 5-(2-hydroxy-5-methyl-benzoyl)-2-imino-N-(2-morpholin-4-ium-4-ylethyl)pyran-3-carboxamide Formula: C20H24N3O5+ MolecularWeight: 386.42166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(=O)C2=COC(=N)C(=C2)C(=O)NCC[NH+]3CCOCC3

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(=O)C2=COC(=N)C(=C2)C(=O)NCC[NH+]3CCOCC3

InChI

InChI=1S/C20H23N3O5/c1-13-2-3-17(24)15(10-13)18(25)14-11-16(19(21)28-12-14)20(26)22-4-5-23-6-8-27-9-7-23/h2-3,10-12,21,24H,4-9H2,1H3,(H,22,26)/p+1