N-(2,5-dimethylpyrrol-1-yl)-4-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxidanylidene-ethoxy]benzamide

Systemtic Name: N-(2,5-dimethylpyrrol-1-yl)-4-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxidanylidene-ethoxy]benzamide Openeye Name: 4-[2-[[(1R)-1,4-dimethylpentyl]amino]-2-oxo-ethoxy]-N-(2,5-dimethylpyrrol-1-yl)benzamide CAS Name: N-(2,5-dimethyl-1-pyrrolyl)-4-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethoxy]benzamide IUPAC Name: N-(2,5-dimethylpyrrol-1-yl)-4-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethoxy]benzamide Traditional Name: 4-[2-[[(1R)-1,4-dimethylpentyl]amino]-2-keto-ethoxy]-N-(2,5-dimethylpyrrol-1-yl)benzamide Formula: C22H31N3O3 MolecularWeight: 385.49984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1NC(=O)C2=CC=C(C=C2)OCC(=O)NC(C)CCC(C)C)C

Isomeric SMILES

CC1=CC=C(N1NC(=O)C2=CC=C(C=C2)OCC(=O)N[C@H](C)CCC(C)C)C

InChI

InChI=1S/C22H31N3O3/c1-15(2)6-7-16(3)23-21(26)14-28-20-12-10-19(11-13-20)22(27)24-25-17(4)8-9-18(25)5/h8-13,15-16H,6-7,14H2,1-5H3,(H,23,26)(H,24,27)/t16-/m1/s1