2-[(4S)-2,2-dimethyl-4-(phenylmethyl)oxan-4-yl]ethyl-(3-morpholin-4-ium-4-ylpropyl)azanium

Systemtic Name: 2-[(4S)-2,2-dimethyl-4-(phenylmethyl)oxan-4-yl]ethyl-(3-morpholin-4-ium-4-ylpropyl)azanium Openeye Name: 2-[(4S)-4-benzyl-2,2-dimethyl-tetrahydropyran-4-yl]ethyl-(3-morpholin-4-ium-4-ylpropyl)ammonium CAS Name: 2-[(4S)-2,2-dimethyl-4-(phenylmethyl)-4-oxanyl]ethyl-[3-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: 2-[(4S)-4-benzyl-2,2-dimethyloxan-4-yl]ethyl-(3-morpholin-4-ium-4-ylpropyl)azanium Traditional Name: 2-[(4S)-4-benzyl-2,2-dimethyl-tetrahydropyran-4-yl]ethyl-(3-morpholin-4-ium-4-ylpropyl)ammonium Formula: C23H40N2O2+2 MolecularWeight: 376.5759

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)(CC[NH2+]CCC[NH+]2CCOCC2)CC3=CC=CC=C3)C

Isomeric SMILES

CC1(C[C@](CCO1)(CC[NH2+]CCC[NH+]2CCOCC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C23H38N2O2/c1-22(2)20-23(10-16-27-22,19-21-7-4-3-5-8-21)9-12-24-11-6-13-25-14-17-26-18-15-25/h3-5,7-8,24H,6,9-20H2,1-2H3/p+2/t23-/m0/s1