(2-methoxyphenyl)-[(3S)-1-[(3-methylquinoxalin-2-yl)methyl]piperidin-1-ium-3-yl]methanone

Systemtic Name: (2-methoxyphenyl)-[(3S)-1-[(3-methylquinoxalin-2-yl)methyl]piperidin-1-ium-3-yl]methanone Openeye Name: (2-methoxyphenyl)-[(3S)-1-[(3-methylquinoxalin-2-yl)methyl]piperidin-1-ium-3-yl]methanone CAS Name: (2-methoxyphenyl)-[(3S)-1-[(3-methyl-2-quinoxalinyl)methyl]-3-piperidin-1-iumyl]methanone IUPAC Name: (2-methoxyphenyl)-[(3S)-1-[(3-methylquinoxalin-2-yl)methyl]piperidin-1-ium-3-yl]methanone Traditional Name: (2-methoxyphenyl)-[(3S)-1-[(3-methylquinoxalin-2-yl)methyl]piperidin-1-ium-3-yl]methanone Formula: C23H26N3O2+ MolecularWeight: 376.47144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1C[NH+]3CCCC(C3)C(=O)C4=CC=CC=C4OC

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1C[NH+]3CCC[C@@H](C3)C(=O)C4=CC=CC=C4OC

InChI

InChI=1S/C23H25N3O2/c1-16-21(25-20-11-5-4-10-19(20)24-16)15-26-13-7-8-17(14-26)23(27)18-9-3-6-12-22(18)28-2/h3-6,9-12,17H,7-8,13-15H2,1-2H3/p+1/t17-/m0/s1