(5S)-4-azanyl-8,8-dimethyl-3-(2-methylpropyl)-5-phenyl-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-3-ium-6-one

Systemtic Name: (5S)-4-azanyl-8,8-dimethyl-3-(2-methylpropyl)-5-phenyl-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-3-ium-6-one Openeye Name: (5S)-4-amino-3-isobutyl-8,8-dimethyl-5-phenyl-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-3-ium-6-one CAS Name: (5S)-4-amino-8,8-dimethyl-3-(2-methylpropyl)-5-phenyl-7,9-dihydro-5H-[1]benzopyrano[2,3-d]pyrimidin-3-ium-6-one IUPAC Name: (5S)-4-amino-8,8-dimethyl-3-(2-methylpropyl)-5-phenyl-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-3-ium-6-one Traditional Name: (5S)-4-amino-3-isobutyl-8,8-dimethyl-5-phenyl-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-3-ium-6-one Formula: C23H28N3O2+ MolecularWeight: 378.48732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[N+]1=C(C2=C(N=C1)OC3=C(C2C4=CC=CC=C4)C(=O)CC(C3)(C)C)N

Isomeric SMILES

CC(C)C[N+]1=C(C2=C(N=C1)OC3=C([C@H]2C4=CC=CC=C4)C(=O)CC(C3)(C)C)N

InChI

InChI=1S/C23H27N3O2/c1-14(2)12-26-13-25-22-20(21(26)24)18(15-8-6-5-7-9-15)19-16(27)10-23(3,4)11-17(19)28-22/h5-9,13-14,18,24H,10-12H2,1-4H3/p+1/t18-/m1/s1