4-(2-chlorophenyl)-7-[2-[3-(phenylmethyl)imidazol-4-yl]ethoxy]-8-propyl-chromen-2-one

Systemtic Name: 4-(2-chlorophenyl)-7-[2-[3-(phenylmethyl)imidazol-4-yl]ethoxy]-8-propyl-chromen-2-one Openeye Name: 7-[2-(3-benzylimidazol-4-yl)ethoxy]-4-(2-chlorophenyl)-8-propyl-chromen-2-one CAS Name: 4-(2-chlorophenyl)-7-[2-[3-(phenylmethyl)-4-imidazolyl]ethoxy]-8-propyl-1-benzopyran-2-one IUPAC Name: 7-[2-(3-benzylimidazol-4-yl)ethoxy]-4-(2-chlorophenyl)-8-propylchromen-2-one Traditional Name: 7-[2-(3-benzylimidazol-4-yl)ethoxy]-4-(2-chlorophenyl)-8-propyl-coumarin Formula: C30H27ClN2O3 MolecularWeight: 498.99998

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OC(=O)C=C2C3=CC=CC=C3Cl)OCCC4=CN=CN4CC5=CC=CC=C5

Isomeric SMILES

CCCC1=C(C=CC2=C1OC(=O)C=C2C3=CC=CC=C3Cl)OCCC4=CN=CN4CC5=CC=CC=C5

InChI

InChI=1S/C30H27ClN2O3/c1-2-8-25-28(35-16-15-22-18-32-20-33(22)19-21-9-4-3-5-10-21)14-13-24-26(17-29(34)36-30(24)25)23-11-6-7-12-27(23)31/h3-7,9-14,17-18,20H,2,8,15-16,19H2,1H3