3-[4-(cyclopropylmethoxy)phenyl]-1-[(3-methoxyphenyl)methyl]-5-phenethyloxy-indole-2-carboxylic acid

Systemtic Name: 3-[4-(cyclopropylmethoxy)phenyl]-1-[(3-methoxyphenyl)methyl]-5-phenethyloxy-indole-2-carboxylic acid Openeye Name: 3-[4-(cyclopropylmethoxy)phenyl]-1-[(3-methoxyphenyl)methyl]-5-phenethyloxy-indole-2-carboxylic acid CAS Name: 3-[4-(cyclopropylmethoxy)phenyl]-1-[(3-methoxyphenyl)methyl]-5-phenethyloxy-2-indolecarboxylic acid IUPAC Name: 3-[4-(cyclopropylmethoxy)phenyl]-1-[(3-methoxyphenyl)methyl]-5-phenethyloxyindole-2-carboxylic acid Traditional Name: 3-[4-(cyclopropylmethoxy)phenyl]-1-m-anisyl-5-phenethyloxy-indole-2-carboxylic acid Formula: C35H33NO5 MolecularWeight: 547.64022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2C3=C(C=C(C=C3)OCCC4=CC=CC=C4)C(=C2C(=O)O)C5=CC=C(C=C5)OCC6CC6

Isomeric SMILES

COC1=CC=CC(=C1)CN2C3=C(C=C(C=C3)OCCC4=CC=CC=C4)C(=C2C(=O)O)C5=CC=C(C=C5)OCC6CC6

InChI

InChI=1S/C35H33NO5/c1-39-29-9-5-8-26(20-29)22-36-32-17-16-30(40-19-18-24-6-3-2-4-7-24)21-31(32)33(34(36)35(37)38)27-12-14-28(15-13-27)41-23-25-10-11-25/h2-9,12-17,20-21,25H,10-11,18-19,22-23H2,1H3,(H,37,38)