4-[2-[2-bromanyl-5-chloranyl-1-(diphenylmethyl)indol-3-yl]ethoxy]benzoic acid

Systemtic Name: 4-[2-[2-bromanyl-5-chloranyl-1-(diphenylmethyl)indol-3-yl]ethoxy]benzoic acid Openeye Name: 4-[2-(1-benzhydryl-2-bromo-5-chloro-indol-3-yl)ethoxy]benzoic acid CAS Name: 4-[2-[2-bromo-5-chloro-1-(diphenylmethyl)-3-indolyl]ethoxy]benzoic acid IUPAC Name: 4-[2-(1-benzhydryl-2-bromo-5-chloroindol-3-yl)ethoxy]benzoic acid Traditional Name: 4-[2-(1-benzhydryl-2-bromo-5-chloro-indol-3-yl)ethoxy]benzoic acid Formula: C30H23BrClNO3 MolecularWeight: 560.86552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)N3C4=C(C=C(C=C4)Cl)C(=C3Br)CCOC5=CC=C(C=C5)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)N3C4=C(C=C(C=C4)Cl)C(=C3Br)CCOC5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C30H23BrClNO3/c31-29-25(17-18-36-24-14-11-22(12-15-24)30(34)35)26-19-23(32)13-16-27(26)33(29)28(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-16,19,28H,17-18H2,(H,34,35)