2,5,7-trimethyl-3-(pyrrolidin-1-ium-1-ylmethyl)-1H-quinolin-4-one

Systemtic Name: 2,5,7-trimethyl-3-(pyrrolidin-1-ium-1-ylmethyl)-1H-quinolin-4-one Openeye Name: 2,5,7-trimethyl-3-(pyrrolidin-1-ium-1-ylmethyl)-1H-quinolin-4-one CAS Name: 2,5,7-trimethyl-3-(1-pyrrolidin-1-iumylmethyl)-1H-quinolin-4-one IUPAC Name: 2,5,7-trimethyl-3-(pyrrolidin-1-ium-1-ylmethyl)-1H-quinolin-4-one Traditional Name: 2,5,7-trimethyl-3-(pyrrolidin-1-ium-1-ylmethyl)-4-quinolone Formula: C17H23N2O+ MolecularWeight: 271.37732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)NC(=C(C2=O)C[NH+]3CCCC3)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)NC(=C(C2=O)C[NH+]3CCCC3)C)C

InChI

InChI=1S/C17H22N2O/c1-11-8-12(2)16-15(9-11)18-13(3)14(17(16)20)10-19-6-4-5-7-19/h8-9H,4-7,10H2,1-3H3,(H,18,20)/p+1