ethyl 1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-3-phenyl-5-phenylmethoxy-indole-2-carboxylate

Systemtic Name: ethyl 1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-3-phenyl-5-phenylmethoxy-indole-2-carboxylate Openeye Name: ethyl 5-benzyloxy-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-phenyl-indole-2-carboxylate CAS Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-phenyl-5-phenylmethoxy-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-phenyl-5-phenylmethoxyindole-2-carboxylate Traditional Name: 5-benzoxy-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-phenyl-indole-2-carboxylic acid ethyl ester Formula: C32H26ClNO5 MolecularWeight: 540.00554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1CC3=CC4=C(C=C3Cl)OCO4)C=CC(=C2)OCC5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1CC3=CC4=C(C=C3Cl)OCO4)C=CC(=C2)OCC5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C32H26ClNO5/c1-2-36-32(35)31-30(22-11-7-4-8-12-22)25-16-24(37-19-21-9-5-3-6-10-21)13-14-27(25)34(31)18-23-15-28-29(17-26(23)33)39-20-38-28/h3-17H,2,18-20H2,1H3