3-[(7R,8R,9aR)-7,8-dimethyl-2-methylsulfonyl-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazin-8-yl]phenol

Systemtic Name: 3-[(7R,8R,9aR)-7,8-dimethyl-2-methylsulfonyl-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazin-8-yl]phenol Openeye Name: 3-[(7R,8R,9aR)-7,8-dimethyl-2-methylsulfonyl-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazin-8-yl]phenol CAS Name: 3-[(7R,8R,9aR)-7,8-dimethyl-2-methylsulfonyl-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazin-8-yl]phenol IUPAC Name: 3-[(7R,8R,9aR)-7,8-dimethyl-2-methylsulfonyl-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazin-8-yl]phenol Traditional Name: 3-[(7R,8R,9aR)-2-mesyl-7,8-dimethyl-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazin-8-yl]phenol Formula: C17H26N2O3S MolecularWeight: 338.46494

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN2CCN(CC2CC1(C)C3=CC(=CC=C3)O)S(=O)(=O)C

Isomeric SMILES

C[C@H]1CN2CCN(C[C@H]2C[C@@]1(C)C3=CC(=CC=C3)O)S(=O)(=O)C

InChI

InChI=1S/C17H26N2O3S/c1-13-11-18-7-8-19(23(3,21)22)12-15(18)10-17(13,2)14-5-4-6-16(20)9-14/h4-6,9,13,15,20H,7-8,10-12H2,1-3H3/t13-,15+,17+/m0/s1