3-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxidanylidene-2-phenyl-chromene-8-carboxamide

Systemtic Name: 3-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxidanylidene-2-phenyl-chromene-8-carboxamide Openeye Name: 3-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxo-2-phenyl-chromene-8-carboxamide CAS Name: 3-methyl-N-[3-(4-morpholin-4-iumyl)propyl]-4-oxo-2-phenyl-1-benzopyran-8-carboxamide IUPAC Name: 3-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxo-2-phenylchromene-8-carboxamide Traditional Name: 4-keto-3-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-2-phenyl-chromene-8-carboxamide Formula: C24H27N2O4+ MolecularWeight: 407.48218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)NCCC[NH+]3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)NCCC[NH+]3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C24H26N2O4/c1-17-21(27)19-9-5-10-20(23(19)30-22(17)18-7-3-2-4-8-18)24(28)25-11-6-12-26-13-15-29-16-14-26/h2-5,7-10H,6,11-16H2,1H3,(H,25,28)/p+1