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

Systemtic Name: (5S)-4-azanyl-3-butyl-5-(4-methoxyphenyl)-8,8-dimethyl-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-3-ium-6-one Openeye Name: (5S)-4-amino-3-butyl-5-(4-methoxyphenyl)-8,8-dimethyl-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-3-ium-6-one CAS Name: (5S)-4-amino-3-butyl-5-(4-methoxyphenyl)-8,8-dimethyl-7,9-dihydro-5H-[1]benzopyrano[2,3-d]pyrimidin-3-ium-6-one IUPAC Name: (5S)-4-amino-3-butyl-5-(4-methoxyphenyl)-8,8-dimethyl-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-3-ium-6-one Traditional Name: (5S)-4-amino-3-butyl-5-(4-methoxyphenyl)-8,8-dimethyl-7,9-dihydro-5H-chromeno[2,3-d]pyrimidin-3-ium-6-one Formula: C24H30N3O3+ MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O3/c1-5-6-11-27-14-26-23-21(22(27)25)19(15-7-9-16(29-4)10-8-15)20-17(28)12-24(2,3)13-18(20)30-23/h7-10,14,19,25H,5-6,11-13H2,1-4H3/p+1/t19-/m1/s1