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

Systemtic Name: 5-butoxy-3-[4-(cyclopropylmethoxy)phenyl]-1-[(3-methoxyphenyl)methyl]indole-2-carboxylic acid Openeye Name: 5-butoxy-3-[4-(cyclopropylmethoxy)phenyl]-1-[(3-methoxyphenyl)methyl]indole-2-carboxylic acid CAS Name: 5-butoxy-3-[4-(cyclopropylmethoxy)phenyl]-1-[(3-methoxyphenyl)methyl]-2-indolecarboxylic acid IUPAC Name: 5-butoxy-3-[4-(cyclopropylmethoxy)phenyl]-1-[(3-methoxyphenyl)methyl]indole-2-carboxylic acid Traditional Name: 5-butoxy-3-[4-(cyclopropylmethoxy)phenyl]-1-m-anisyl-indole-2-carboxylic acid Formula: C31H33NO5 MolecularWeight: 499.59742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)N(C(=C2C3=CC=C(C=C3)OCC4CC4)C(=O)O)CC5=CC(=CC=C5)OC

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)N(C(=C2C3=CC=C(C=C3)OCC4CC4)C(=O)O)CC5=CC(=CC=C5)OC

InChI

InChI=1S/C31H33NO5/c1-3-4-16-36-26-14-15-28-27(18-26)29(23-10-12-24(13-11-23)37-20-21-8-9-21)30(31(33)34)32(28)19-22-6-5-7-25(17-22)35-2/h5-7,10-15,17-18,21H,3-4,8-9,16,19-20H2,1-2H3,(H,33,34)