4-[[3-[(4-oxidanylidene-1H-quinolin-2-yl)amino]propylamino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[3-[(4-oxidanylidene-1H-quinolin-2-yl)amino]propylamino]methyl]benzenecarbonitrile Openeye Name: 4-[[3-[(4-oxo-1H-quinolin-2-yl)amino]propylamino]methyl]benzonitrile CAS Name: 4-[[3-[(4-oxo-1H-quinolin-2-yl)amino]propylamino]methyl]benzonitrile IUPAC Name: 4-[[3-[(4-oxo-1H-quinolin-2-yl)amino]propylamino]methyl]benzonitrile Traditional Name: 4-[[3-[(4-keto-1H-quinolin-2-yl)amino]propylamino]methyl]benzonitrile Formula: C20H20N4O MolecularWeight: 332.399

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C=C(N2)NCCCNCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C=C(N2)NCCCNCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H20N4O/c21-13-15-6-8-16(9-7-15)14-22-10-3-11-23-20-12-19(25)17-4-1-2-5-18(17)24-20/h1-2,4-9,12,22H,3,10-11,14H2,(H2,23,24,25)