4-[3-(5-azanyl-2,5-dimethyl-1,2-dihydropyrrol-4-yl)-3-oxidanylidene-propyl]benzenecarbonitrile

Systemtic Name: 4-[3-(5-azanyl-2,5-dimethyl-1,2-dihydropyrrol-4-yl)-3-oxidanylidene-propyl]benzenecarbonitrile Openeye Name: 4-[3-(5-amino-2,5-dimethyl-1,2-dihydropyrrol-4-yl)-3-oxo-propyl]benzonitrile CAS Name: 4-[3-(5-amino-2,5-dimethyl-1,2-dihydropyrrol-4-yl)-3-oxopropyl]benzonitrile IUPAC Name: 4-[3-(5-amino-2,5-dimethyl-1,2-dihydropyrrol-4-yl)-3-oxopropyl]benzonitrile Traditional Name: 4-[3-(2-amino-2,5-dimethyl-3-pyrrolin-3-yl)-3-keto-propyl]benzonitrile Formula: C16H19N3O MolecularWeight: 269.34156

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=C(C(N1)(C)N)C(=O)CCC2=CC=C(C=C2)C#N

Isomeric SMILES

CC1C=C(C(N1)(C)N)C(=O)CCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H19N3O/c1-11-9-14(16(2,18)19-11)15(20)8-7-12-3-5-13(10-17)6-4-12/h3-6,9,11,19H,7-8,18H2,1-2H3