3-(2-chloranyl-4-pyrrolidin-1-ylcarbonyl-phenoxy)-N-(1-methylpyrazol-3-yl)-5-[(2S)-1-oxidanylbutan-2-yl]oxy-benzamide

Systemtic Name: 3-(2-chloranyl-4-pyrrolidin-1-ylcarbonyl-phenoxy)-N-(1-methylpyrazol-3-yl)-5-[(2S)-1-oxidanylbutan-2-yl]oxy-benzamide Openeye Name: 3-[2-chloro-4-(pyrrolidine-1-carbonyl)phenoxy]-5-[(1S)-1-(hydroxymethyl)propoxy]-N-(1-methylpyrazol-3-yl)benzamide CAS Name: 3-[2-chloro-4-[oxo(1-pyrrolidinyl)methyl]phenoxy]-5-[(2S)-1-hydroxybutan-2-yl]oxy-N-(1-methyl-3-pyrazolyl)benzamide IUPAC Name: 3-[2-chloro-4-(pyrrolidine-1-carbonyl)phenoxy]-5-[(2S)-1-hydroxybutan-2-yl]oxy-N-(1-methylpyrazol-3-yl)benzamide Traditional Name: 3-[2-chloro-4-(pyrrolidine-1-carbonyl)phenoxy]-5-[(1S)-1-methylolpropoxy]-N-(1-methylpyrazol-3-yl)benzamide Formula: C26H29ClN4O5 MolecularWeight: 512.98526

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)OC1=CC(=CC(=C1)OC2=C(C=C(C=C2)C(=O)N3CCCC3)Cl)C(=O)NC4=NN(C=C4)C

Isomeric SMILES

CC[C@@H](CO)OC1=CC(=CC(=C1)OC2=C(C=C(C=C2)C(=O)N3CCCC3)Cl)C(=O)NC4=NN(C=C4)C

InChI

InChI=1S/C26H29ClN4O5/c1-3-19(16-32)35-20-12-18(25(33)28-24-8-11-30(2)29-24)13-21(15-20)36-23-7-6-17(14-22(23)27)26(34)31-9-4-5-10-31/h6-8,11-15,19,32H,3-5,9-10,16H2,1-2H3,(H,28,29,33)/t19-/m0/s1