5-[4-(5-azanylpentoxy)-3-chloranyl-phenyl]-6-methyl-2-oxidanylidene-1H-pyridine-3-carbonitrile

Systemtic Name: 5-[4-(5-azanylpentoxy)-3-chloranyl-phenyl]-6-methyl-2-oxidanylidene-1H-pyridine-3-carbonitrile Openeye Name: 5-[4-(5-aminopentoxy)-3-chloro-phenyl]-6-methyl-2-oxo-1H-pyridine-3-carbonitrile CAS Name: 5-[4-(5-aminopentoxy)-3-chlorophenyl]-6-methyl-2-oxo-1H-pyridine-3-carbonitrile IUPAC Name: 5-[4-(5-aminopentoxy)-3-chlorophenyl]-6-methyl-2-oxo-1H-pyridine-3-carbonitrile Traditional Name: 5-[4-(5-aminopentoxy)-3-chloro-phenyl]-2-keto-6-methyl-1H-pyridine-3-carbonitrile Formula: C18H20ClN3O2 MolecularWeight: 345.8233

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=O)N1)C#N)C2=CC(=C(C=C2)OCCCCCN)Cl

Isomeric SMILES

CC1=C(C=C(C(=O)N1)C#N)C2=CC(=C(C=C2)OCCCCCN)Cl

InChI

InChI=1S/C18H20ClN3O2/c1-12-15(9-14(11-21)18(23)22-12)13-5-6-17(16(19)10-13)24-8-4-2-3-7-20/h5-6,9-10H,2-4,7-8,20H2,1H3,(H,22,23)