(10aS)-10a-[(E)-2-(4-butoxy-3-ethoxy-phenyl)ethenyl]-8,10,10-trimethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one

Systemtic Name: (10aS)-10a-[(E)-2-(4-butoxy-3-ethoxy-phenyl)ethenyl]-8,10,10-trimethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one Openeye Name: (10aS)-10a-[(E)-2-(4-butoxy-3-ethoxy-phenyl)vinyl]-8,10,10-trimethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one CAS Name: (10aS)-10a-[(E)-2-(4-butoxy-3-ethoxyphenyl)ethenyl]-8,10,10-trimethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one IUPAC Name: (10aS)-10a-[(E)-2-(4-butoxy-3-ethoxyphenyl)ethenyl]-8,10,10-trimethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one Traditional Name: (10aS)-10a-[(E)-2-(4-butoxy-3-ethoxy-phenyl)vinyl]-8,10,10-trimethyl-3,4-dihydro-1H-pyrimid[1,2-a]indol-2-one Formula: C28H36N2O3 MolecularWeight: 448.59704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=CC23C(C4=C(N2CCC(=O)N3)C=CC(=C4)C)(C)C)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C/[C@@]23C(C4=C(N2CCC(=O)N3)C=CC(=C4)C)(C)C)OCC

InChI

InChI=1S/C28H36N2O3/c1-6-8-17-33-24-12-10-21(19-25(24)32-7-2)13-15-28-27(4,5)22-18-20(3)9-11-23(22)30(28)16-14-26(31)29-28/h9-13,15,18-19H,6-8,14,16-17H2,1-5H3,(H,29,31)/b15-13+/t28-/m0/s1