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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC(N1C(=O)C(CC2=CC=C(C=C2)C#N)N)C

Isomeric SMILES

CC1C=CC(N1C(=O)C(CC2=CC=C(C=C2)C#N)N)C

InChI

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