(10aS)-10a-[(E)-2-[4-[(4-chlorophenyl)methoxy]-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-[(4-chlorophenyl)methoxy]-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-[(4-chlorophenyl)methoxy]-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-[(4-chlorophenyl)methoxy]-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-[(4-chlorophenyl)methoxy]-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-(4-chlorobenzyl)oxy-3-ethoxy-phenyl]vinyl]-8,10,10-trimethyl-3,4-dihydro-1H-pyrimid[1,2-a]indol-2-one Formula: C31H33ClN2O3 MolecularWeight: 517.05832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC23C(C4=C(N2CCC(=O)N3)C=CC(=C4)C)(C)C)OCC5=CC=C(C=C5)Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/[C@@]23C(C4=C(N2CCC(=O)N3)C=CC(=C4)C)(C)C)OCC5=CC=C(C=C5)Cl

InChI

InChI=1S/C31H33ClN2O3/c1-5-36-28-19-22(9-13-27(28)37-20-23-7-10-24(32)11-8-23)14-16-31-30(3,4)25-18-21(2)6-12-26(25)34(31)17-15-29(35)33-31/h6-14,16,18-19H,5,15,17,20H2,1-4H3,(H,33,35)/b16-14+/t31-/m0/s1