methyl-(phenylmethyl)-[(2,5,7-trimethyl-4-oxidanylidene-1H-quinolin-3-yl)methyl]azanium

Systemtic Name: methyl-(phenylmethyl)-[(2,5,7-trimethyl-4-oxidanylidene-1H-quinolin-3-yl)methyl]azanium Openeye Name: benzyl-methyl-[(2,5,7-trimethyl-4-oxo-1H-quinolin-3-yl)methyl]ammonium CAS Name: methyl-(phenylmethyl)-[(2,5,7-trimethyl-4-oxo-1H-quinolin-3-yl)methyl]ammonium IUPAC Name: benzyl-methyl-[(2,5,7-trimethyl-4-oxo-1H-quinolin-3-yl)methyl]azanium Traditional Name: benzyl-[(4-keto-2,5,7-trimethyl-1H-quinolin-3-yl)methyl]-methyl-ammonium Formula: C21H25N2O+ MolecularWeight: 321.436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)NC(=C(C2=O)C[NH+](C)CC3=CC=CC=C3)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)NC(=C(C2=O)C[NH+](C)CC3=CC=CC=C3)C)C

InChI

InChI=1S/C21H24N2O/c1-14-10-15(2)20-19(11-14)22-16(3)18(21(20)24)13-23(4)12-17-8-6-5-7-9-17/h5-11H,12-13H2,1-4H3,(H,22,24)/p+1