ethyl 1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-5-[(4-methoxyphenyl)methoxy]indole-2-carboxylate

Systemtic Name: ethyl 1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-5-[(4-methoxyphenyl)methoxy]indole-2-carboxylate Openeye Name: ethyl 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-[(4-methoxyphenyl)methoxy]indole-2-carboxylate CAS Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-[(4-methoxyphenyl)methoxy]-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-[(4-methoxyphenyl)methoxy]indole-2-carboxylate Traditional Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-p-anisyloxy-indole-2-carboxylic acid ethyl ester Formula: C27H24ClNO6 MolecularWeight: 493.93556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N1CC3=CC4=C(C=C3Cl)OCO4)C=CC(=C2)OCC5=CC=C(C=C5)OC

Isomeric SMILES

CCOC(=O)C1=CC2=C(N1CC3=CC4=C(C=C3Cl)OCO4)C=CC(=C2)OCC5=CC=C(C=C5)OC

InChI

InChI=1S/C27H24ClNO6/c1-3-32-27(30)24-11-18-10-21(33-15-17-4-6-20(31-2)7-5-17)8-9-23(18)29(24)14-19-12-25-26(13-22(19)28)35-16-34-25/h4-13H,3,14-16H2,1-2H3