4-[4-(2-chloranyl-4-methyl-phenoxy)phenoxy]-2-(1-methylpyrrol-2-yl)-3-oxidanylidene-pentanenitrile

Systemtic Name: 4-[4-(2-chloranyl-4-methyl-phenoxy)phenoxy]-2-(1-methylpyrrol-2-yl)-3-oxidanylidene-pentanenitrile Openeye Name: 4-[4-(2-chloro-4-methyl-phenoxy)phenoxy]-2-(1-methylpyrrol-2-yl)-3-oxo-pentanenitrile CAS Name: 4-[4-(2-chloro-4-methylphenoxy)phenoxy]-2-(1-methyl-2-pyrrolyl)-3-oxopentanenitrile IUPAC Name: 4-[4-(2-chloro-4-methylphenoxy)phenoxy]-2-(1-methylpyrrol-2-yl)-3-oxopentanenitrile Traditional Name: 4-[4-(2-chloro-4-methyl-phenoxy)phenoxy]-3-keto-2-(1-methylpyrrol-2-yl)valeronitrile Formula: C23H21ClN2O3 MolecularWeight: 408.87744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2=CC=C(C=C2)OC(C)C(=O)C(C#N)C3=CC=CN3C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)OC2=CC=C(C=C2)OC(C)C(=O)C(C#N)C3=CC=CN3C)Cl

InChI

InChI=1S/C23H21ClN2O3/c1-15-6-11-22(20(24)13-15)29-18-9-7-17(8-10-18)28-16(2)23(27)19(14-25)21-5-4-12-26(21)3/h4-13,16,19H,1-3H3