2-methyl-3-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]quinazolin-4-one

Systemtic Name: 2-methyl-3-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]quinazolin-4-one Openeye Name: 3-[(4-benzylpiperidin-1-ium-1-yl)methyl]-2-methyl-quinazolin-4-one CAS Name: 2-methyl-3-[[4-(phenylmethyl)-1-piperidin-1-iumyl]methyl]-4-quinazolinone IUPAC Name: 3-[(4-benzylpiperidin-1-ium-1-yl)methyl]-2-methylquinazolin-4-one Traditional Name: 3-[(4-benzylpiperidin-1-ium-1-yl)methyl]-2-methyl-quinazolin-4-one Formula: C22H26N3O+ MolecularWeight: 348.46134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1C[NH+]3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1C[NH+]3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H25N3O/c1-17-23-21-10-6-5-9-20(21)22(26)25(17)16-24-13-11-19(12-14-24)15-18-7-3-2-4-8-18/h2-10,19H,11-16H2,1H3/p+1