5-[3-azanyl-1-(3-chlorophenyl)butan-2-yl]pyridine-3-carbonitrile

Systemtic Name: 5-[3-azanyl-1-(3-chlorophenyl)butan-2-yl]pyridine-3-carbonitrile Openeye Name: 5-[2-amino-1-[(3-chlorophenyl)methyl]propyl]pyridine-3-carbonitrile CAS Name: 5-[3-amino-1-(3-chlorophenyl)butan-2-yl]-3-pyridinecarbonitrile IUPAC Name: 5-[3-amino-1-(3-chlorophenyl)butan-2-yl]pyridine-3-carbonitrile Traditional Name: 5-[2-amino-1-(3-chlorobenzyl)propyl]nicotinonitrile Formula: C16H16ClN3 MolecularWeight: 285.77134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC1=CC(=CC=C1)Cl)C2=CN=CC(=C2)C#N)N

Isomeric SMILES

CC(C(CC1=CC(=CC=C1)Cl)C2=CN=CC(=C2)C#N)N

InChI

InChI=1S/C16H16ClN3/c1-11(19)16(7-12-3-2-4-15(17)6-12)14-5-13(8-18)9-20-10-14/h2-6,9-11,16H,7,19H2,1H3