2-[2-[4-[7-bromanyl-1-(2-ethoxyethyl)indol-3-yl]piperidin-1-yl]ethoxy]-5-methyl-benzoic acid

Systemtic Name: 2-[2-[4-[7-bromanyl-1-(2-ethoxyethyl)indol-3-yl]piperidin-1-yl]ethoxy]-5-methyl-benzoic acid Openeye Name: 2-[2-[4-[7-bromo-1-(2-ethoxyethyl)indol-3-yl]-1-piperidyl]ethoxy]-5-methyl-benzoic acid CAS Name: 2-[2-[4-[7-bromo-1-(2-ethoxyethyl)-3-indolyl]-1-piperidinyl]ethoxy]-5-methylbenzoic acid IUPAC Name: 2-[2-[4-[7-bromo-1-(2-ethoxyethyl)indol-3-yl]piperidin-1-yl]ethoxy]-5-methylbenzoic acid Traditional Name: 2-[2-[4-[7-bromo-1-(2-ethoxyethyl)indol-3-yl]piperidino]ethoxy]-5-methyl-benzoic acid Formula: C27H33BrN2O4 MolecularWeight: 529.46592

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C=C(C2=C1C(=CC=C2)Br)C3CCN(CC3)CCOC4=C(C=C(C=C4)C)C(=O)O

Isomeric SMILES

CCOCCN1C=C(C2=C1C(=CC=C2)Br)C3CCN(CC3)CCOC4=C(C=C(C=C4)C)C(=O)O

InChI

InChI=1S/C27H33BrN2O4/c1-3-33-15-14-30-18-23(21-5-4-6-24(28)26(21)30)20-9-11-29(12-10-20)13-16-34-25-8-7-19(2)17-22(25)27(31)32/h4-8,17-18,20H,3,9-16H2,1-2H3,(H,31,32)