2-[2-(3-methyl-4-propan-2-yl-phenoxy)ethoxy]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-[2-(3-methyl-4-propan-2-yl-phenoxy)ethoxy]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-[2-(4-isopropyl-3-methyl-phenoxy)ethoxy]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-[2-(3-methyl-4-propan-2-ylphenoxy)ethoxy]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-[2-(3-methyl-4-propan-2-ylphenoxy)ethoxy]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-[2-(4-isopropyl-3-methyl-phenoxy)ethoxy]-5-pyrrolidinosulfonyl-benzamide Formula: C23H30N2O5S MolecularWeight: 446.5597

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCOC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)C(=O)N)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCCOC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)C(=O)N)C(C)C

InChI

InChI=1S/C23H30N2O5S/c1-16(2)20-8-6-18(14-17(20)3)29-12-13-30-22-9-7-19(15-21(22)23(24)26)31(27,28)25-10-4-5-11-25/h6-9,14-16H,4-5,10-13H2,1-3H3,(H2,24,26)