(3S,7R,8R,9aR)-3-cyclohexyl-8-(3-hydroxyphenyl)-7,8-dimethyl-2,3,6,7,9,9a-hexahydropyrido[1,2-a]pyrazine-1,4-dione

Systemtic Name: (3S,7R,8R,9aR)-3-cyclohexyl-8-(3-hydroxyphenyl)-7,8-dimethyl-2,3,6,7,9,9a-hexahydropyrido[1,2-a]pyrazine-1,4-dione Openeye Name: (3S,7R,8R,9aR)-3-cyclohexyl-8-(3-hydroxyphenyl)-7,8-dimethyl-2,3,6,7,9,9a-hexahydropyrido[1,2-a]pyrazine-1,4-dione CAS Name: (3S,7R,8R,9aR)-3-cyclohexyl-8-(3-hydroxyphenyl)-7,8-dimethyl-2,3,6,7,9,9a-hexahydropyrido[1,2-a]pyrazine-1,4-dione IUPAC Name: (3S,7R,8R,9aR)-3-cyclohexyl-8-(3-hydroxyphenyl)-7,8-dimethyl-2,3,6,7,9,9a-hexahydropyrido[1,2-a]pyrazine-1,4-dione Traditional Name: (3S,7R,8R,9aR)-3-cyclohexyl-8-(3-hydroxyphenyl)-7,8-dimethyl-2,3,6,7,9,9a-hexahydropyrido[1,2-a]pyrazine-1,4-quinone Formula: C22H30N2O3 MolecularWeight: 370.4852

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN2C(CC1(C)C3=CC(=CC=C3)O)C(=O)NC(C2=O)C4CCCCC4

Isomeric SMILES

C[C@H]1CN2[C@H](C[C@@]1(C)C3=CC(=CC=C3)O)C(=O)N[C@H](C2=O)C4CCCCC4

InChI

InChI=1S/C22H30N2O3/c1-14-13-24-18(12-22(14,2)16-9-6-10-17(25)11-16)20(26)23-19(21(24)27)15-7-4-3-5-8-15/h6,9-11,14-15,18-19,25H,3-5,7-8,12-13H2,1-2H3,(H,23,26)/t14-,18+,19-,22+/m0/s1