1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-5-[(2-phenoxyphenyl)methoxy]indole-2-carboxylic acid

Systemtic Name: 1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-5-[(2-phenoxyphenyl)methoxy]indole-2-carboxylic acid Openeye Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-[(2-phenoxyphenyl)methoxy]indole-2-carboxylic acid CAS Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-[(2-phenoxyphenyl)methoxy]-2-indolecarboxylic acid IUPAC Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-[(2-phenoxyphenyl)methoxy]indole-2-carboxylic acid Traditional Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-5-(2-phenoxybenzyl)oxy-indole-2-carboxylic acid Formula: C30H22ClNO6 MolecularWeight: 527.95178

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)CN3C4=C(C=C(C=C4)OCC5=CC=CC=C5OC6=CC=CC=C6)C=C3C(=O)O)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)CN3C4=C(C=C(C=C4)OCC5=CC=CC=C5OC6=CC=CC=C6)C=C3C(=O)O)Cl

InChI

InChI=1S/C30H22ClNO6/c31-24-15-29-28(36-18-37-29)14-21(24)16-32-25-11-10-23(12-20(25)13-26(32)30(33)34)35-17-19-6-4-5-9-27(19)38-22-7-2-1-3-8-22/h1-15H,16-18H2,(H,33,34)