4-[1-[[6-chloranyl-5-(hydroxymethyl)pyridin-3-yl]methyl]-5-cyclopropyl-2-methyl-pyrrol-3-yl]benzenecarbonitrile

Systemtic Name: 4-[1-[[6-chloranyl-5-(hydroxymethyl)pyridin-3-yl]methyl]-5-cyclopropyl-2-methyl-pyrrol-3-yl]benzenecarbonitrile Openeye Name: 4-[1-[[6-chloro-5-(hydroxymethyl)-3-pyridyl]methyl]-5-cyclopropyl-2-methyl-pyrrol-3-yl]benzonitrile CAS Name: 4-[1-[[6-chloro-5-(hydroxymethyl)-3-pyridinyl]methyl]-5-cyclopropyl-2-methyl-3-pyrrolyl]benzonitrile IUPAC Name: 4-[1-[[6-chloro-5-(hydroxymethyl)pyridin-3-yl]methyl]-5-cyclopropyl-2-methylpyrrol-3-yl]benzonitrile Traditional Name: 4-[1-[(6-chloro-5-methylol-3-pyridyl)methyl]-5-cyclopropyl-2-methyl-pyrrol-3-yl]benzonitrile Formula: C22H20ClN3O MolecularWeight: 377.8667

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CC2=CC(=C(N=C2)Cl)CO)C3CC3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=C(C=C(N1CC2=CC(=C(N=C2)Cl)CO)C3CC3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H20ClN3O/c1-14-20(17-4-2-15(10-24)3-5-17)9-21(18-6-7-18)26(14)12-16-8-19(13-27)22(23)25-11-16/h2-5,8-9,11,18,27H,6-7,12-13H2,1H3