[1-(5-methyl-3-pyrrol-1-yl-pyridin-2-yl)oxy-3-(propan-2-ylamino)propan-2-yl] benzoate

Systemtic Name: [1-(5-methyl-3-pyrrol-1-yl-pyridin-2-yl)oxy-3-(propan-2-ylamino)propan-2-yl] benzoate Openeye Name: [1-[(isopropylamino)methyl]-2-[(5-methyl-3-pyrrol-1-yl-2-pyridyl)oxy]ethyl] benzoate CAS Name: benzoic acid [1-[[5-methyl-3-(1-pyrrolyl)-2-pyridinyl]oxy]-3-(propan-2-ylamino)propan-2-yl] ester IUPAC Name: [1-(5-methyl-3-pyrrol-1-ylpyridin-2-yl)oxy-3-(propan-2-ylamino)propan-2-yl] benzoate Traditional Name: benzoic acid [1-[(isopropylamino)methyl]-2-[(5-methyl-3-pyrrol-1-yl-2-pyridyl)oxy]ethyl] ester Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N=C1)OCC(CNC(C)C)OC(=O)C2=CC=CC=C2)N3C=CC=C3

Isomeric SMILES

CC1=CC(=C(N=C1)OCC(CNC(C)C)OC(=O)C2=CC=CC=C2)N3C=CC=C3

InChI

InChI=1S/C23H27N3O3/c1-17(2)24-15-20(29-23(27)19-9-5-4-6-10-19)16-28-22-21(13-18(3)14-25-22)26-11-7-8-12-26/h4-14,17,20,24H,15-16H2,1-3H3