2-[1-(4-chlorophenyl)-7-methoxy-pyrimido[1,6-a]indol-5-yl]ethanoic acid

Systemtic Name: 2-[1-(4-chlorophenyl)-7-methoxy-pyrimido[1,6-a]indol-5-yl]ethanoic acid Openeye Name: 2-[1-(4-chlorophenyl)-7-methoxy-pyrimido[1,6-a]indol-5-yl]acetic acid CAS Name: 2-[1-(4-chlorophenyl)-7-methoxy-5-pyrimido[1,6-a]indolyl]acetic acid IUPAC Name: 2-[1-(4-chlorophenyl)-7-methoxypyrimido[1,6-a]indol-5-yl]acetic acid Traditional Name: 2-[1-(4-chlorophenyl)-7-methoxy-pyrimid[1,6-a]indol-5-yl]acetic acid Formula: C20H15ClN2O3 MolecularWeight: 366.7977

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N3C(=C2CC(=O)O)C=CN=C3C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)N3C(=C2CC(=O)O)C=CN=C3C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H15ClN2O3/c1-26-14-6-7-17-15(10-14)16(11-19(24)25)18-8-9-22-20(23(17)18)12-2-4-13(21)5-3-12/h2-10H,11H2,1H3,(H,24,25)