2-[(2R,4S)-4-(4-methylphenyl)-2-propan-2-yl-oxan-4-yl]ethyl-[(1S)-1-thiophen-2-ylethyl]azanium

Systemtic Name: 2-[(2R,4S)-4-(4-methylphenyl)-2-propan-2-yl-oxan-4-yl]ethyl-[(1S)-1-thiophen-2-ylethyl]azanium Openeye Name: 2-[(2R,4S)-2-isopropyl-4-(p-tolyl)tetrahydropyran-4-yl]ethyl-[(1S)-1-(2-thienyl)ethyl]ammonium CAS Name: 2-[(2R,4S)-4-(4-methylphenyl)-2-propan-2-yl-4-oxanyl]ethyl-[(1S)-1-thiophen-2-ylethyl]ammonium IUPAC Name: 2-[(2R,4S)-4-(4-methylphenyl)-2-propan-2-yloxan-4-yl]ethyl-[(1S)-1-thiophen-2-ylethyl]azanium Traditional Name: 2-[(2R,4S)-2-isopropyl-4-(p-tolyl)tetrahydropyran-4-yl]ethyl-[(1S)-1-(2-thienyl)ethyl]ammonium Formula: C23H34NOS+ MolecularWeight: 372.58716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(CCOC(C2)C(C)C)CC[NH2+]C(C)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)[C@]2(CCO[C@H](C2)C(C)C)CC[NH2+][C@@H](C)C3=CC=CS3

InChI

InChI=1S/C23H33NOS/c1-17(2)21-16-23(12-14-25-21,20-9-7-18(3)8-10-20)11-13-24-19(4)22-6-5-15-26-22/h5-10,15,17,19,21,24H,11-14,16H2,1-4H3/p+1/t19-,21+,23-/m0/s1