N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-(7-methyl-2-oxidanylidene-chromen-4-yl)ethanamide

Systemtic Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-(7-methyl-2-oxidanylidene-chromen-4-yl)ethanamide Openeye Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-(7-methyl-2-oxo-chromen-4-yl)acetamide CAS Name: N-[(3S)-1-cycloheptyl-3-piperidin-1-iumyl]-2-(7-methyl-2-oxo-1-benzopyran-4-yl)acetamide IUPAC Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-(7-methyl-2-oxochromen-4-yl)acetamide Traditional Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-(2-keto-7-methyl-chromen-4-yl)acetamide Formula: C24H33N2O3+ MolecularWeight: 397.53042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)NC3CCC[NH+](C3)C4CCCCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)N[C@H]3CCC[NH+](C3)C4CCCCCC4

InChI

InChI=1S/C24H32N2O3/c1-17-10-11-21-18(15-24(28)29-22(21)13-17)14-23(27)25-19-7-6-12-26(16-19)20-8-4-2-3-5-9-20/h10-11,13,15,19-20H,2-9,12,14,16H2,1H3,(H,25,27)/p+1/t19-/m0/s1