(7S)-3-cyclohexyl-1-(2-methoxyethyl)-7-phenyl-2,3,4,6,7,8-hexahydroquinazolin-3-ium-5-one

Systemtic Name: (7S)-3-cyclohexyl-1-(2-methoxyethyl)-7-phenyl-2,3,4,6,7,8-hexahydroquinazolin-3-ium-5-one Openeye Name: (7S)-3-cyclohexyl-1-(2-methoxyethyl)-7-phenyl-2,3,4,6,7,8-hexahydroquinazolin-3-ium-5-one CAS Name: (7S)-3-cyclohexyl-1-(2-methoxyethyl)-7-phenyl-2,3,4,6,7,8-hexahydroquinazolin-3-ium-5-one IUPAC Name: (7S)-3-cyclohexyl-1-(2-methoxyethyl)-7-phenyl-2,3,4,6,7,8-hexahydroquinazolin-3-ium-5-one Traditional Name: (7S)-3-cyclohexyl-1-(2-methoxyethyl)-7-phenyl-2,3,4,6,7,8-hexahydroquinazolin-3-ium-5-one Formula: C23H33N2O2+ MolecularWeight: 369.52032

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C[NH+](CC2=C1CC(CC2=O)C3=CC=CC=C3)C4CCCCC4

Isomeric SMILES

COCCN1C[NH+](CC2=C1C[C@@H](CC2=O)C3=CC=CC=C3)C4CCCCC4

InChI

InChI=1S/C23H32N2O2/c1-27-13-12-24-17-25(20-10-6-3-7-11-20)16-21-22(24)14-19(15-23(21)26)18-8-4-2-5-9-18/h2,4-5,8-9,19-20H,3,6-7,10-17H2,1H3/p+1/t19-/m0/s1