N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]-N-methyl-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]-N-methyl-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[(3S)-1-indan-2-ylpiperidin-1-ium-3-yl]-N-methyl-2-oxo-chromene-3-carboxamide CAS Name: N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)-3-piperidin-1-iumyl]-N-methyl-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]-N-methyl-2-oxochromene-3-carboxamide Traditional Name: N-[(3S)-1-indan-2-ylpiperidin-1-ium-3-yl]-2-keto-N-methyl-chromene-3-carboxamide Formula: C25H27N2O3+ MolecularWeight: 403.49348

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC[NH+](C1)C2CC3=CC=CC=C3C2)C(=O)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

CN([C@H]1CCC[NH+](C1)C2CC3=CC=CC=C3C2)C(=O)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C25H26N2O3/c1-26(24(28)22-15-19-9-4-5-11-23(19)30-25(22)29)20-10-6-12-27(16-20)21-13-17-7-2-3-8-18(17)14-21/h2-5,7-9,11,15,20-21H,6,10,12-14,16H2,1H3/p+1/t20-/m0/s1