2-[[2-[[1-[(3,5-diethoxy-4-pyrrol-1-yl-phenyl)methyl]piperidin-4-yl]amino]-1,3-benzoxazol-7-yl]oxy]ethanoic acid

Systemtic Name: 2-[[2-[[1-[(3,5-diethoxy-4-pyrrol-1-yl-phenyl)methyl]piperidin-4-yl]amino]-1,3-benzoxazol-7-yl]oxy]ethanoic acid Openeye Name: 2-[[2-[[1-[(3,5-diethoxy-4-pyrrol-1-yl-phenyl)methyl]-4-piperidyl]amino]-1,3-benzoxazol-7-yl]oxy]acetic acid CAS Name: 2-[[2-[[1-[[3,5-diethoxy-4-(1-pyrrolyl)phenyl]methyl]-4-piperidinyl]amino]-1,3-benzoxazol-7-yl]oxy]acetic acid IUPAC Name: 2-[[2-[[1-[(3,5-diethoxy-4-pyrrol-1-ylphenyl)methyl]piperidin-4-yl]amino]-1,3-benzoxazol-7-yl]oxy]acetic acid Traditional Name: 2-[[2-[[1-(3,5-diethoxy-4-pyrrol-1-yl-benzyl)-4-piperidyl]amino]-1,3-benzoxazol-7-yl]oxy]acetic acid Formula: C29H34N4O6 MolecularWeight: 534.60346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1N2C=CC=C2)OCC)CN3CCC(CC3)NC4=NC5=C(O4)C(=CC=C5)OCC(=O)O

Isomeric SMILES

CCOC1=CC(=CC(=C1N2C=CC=C2)OCC)CN3CCC(CC3)NC4=NC5=C(O4)C(=CC=C5)OCC(=O)O

InChI

InChI=1S/C29H34N4O6/c1-3-36-24-16-20(17-25(37-4-2)27(24)33-12-5-6-13-33)18-32-14-10-21(11-15-32)30-29-31-22-8-7-9-23(28(22)39-29)38-19-26(34)35/h5-9,12-13,16-17,21H,3-4,10-11,14-15,18-19H2,1-2H3,(H,30,31)(H,34,35)