1,3-bis(1,3-benzodioxol-5-yl)-5-phenylmethoxy-indole-2-carboxylic acid

Systemtic Name: 1,3-bis(1,3-benzodioxol-5-yl)-5-phenylmethoxy-indole-2-carboxylic acid Openeye Name: 1,3-bis(1,3-benzodioxol-5-yl)-5-benzyloxy-indole-2-carboxylic acid CAS Name: 1,3-bis(1,3-benzodioxol-5-yl)-5-phenylmethoxy-2-indolecarboxylic acid IUPAC Name: 1,3-bis(1,3-benzodioxol-5-yl)-5-phenylmethoxyindole-2-carboxylic acid Traditional Name: 1,3-bis(1,3-benzodioxol-5-yl)-5-benzoxy-indole-2-carboxylic acid Formula: C30H21NO7 MolecularWeight: 507.49024

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=C(N(C4=C3C=C(C=C4)OCC5=CC=CC=C5)C6=CC7=C(C=C6)OCO7)C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=C(N(C4=C3C=C(C=C4)OCC5=CC=CC=C5)C6=CC7=C(C=C6)OCO7)C(=O)O

InChI

InChI=1S/C30H21NO7/c32-30(33)29-28(19-6-10-24-26(12-19)37-16-35-24)22-14-21(34-15-18-4-2-1-3-5-18)8-9-23(22)31(29)20-7-11-25-27(13-20)38-17-36-25/h1-14H,15-17H2,(H,32,33)