6-chloranyl-4-[naphthalen-2-ylmethyl(piperidin-4-yl)amino]-2-oxidanylidene-1H-quinoline-3-carbonitrile

Systemtic Name: 6-chloranyl-4-[naphthalen-2-ylmethyl(piperidin-4-yl)amino]-2-oxidanylidene-1H-quinoline-3-carbonitrile Openeye Name: 6-chloro-4-[2-naphthylmethyl(4-piperidyl)amino]-2-oxo-1H-quinoline-3-carbonitrile CAS Name: 6-chloro-4-[2-naphthalenylmethyl(4-piperidinyl)amino]-2-oxo-1H-quinoline-3-carbonitrile IUPAC Name: 6-chloro-4-[naphthalen-2-ylmethyl(piperidin-4-yl)amino]-2-oxo-1H-quinoline-3-carbonitrile Traditional Name: 6-chloro-2-keto-4-[2-naphthylmethyl(4-piperidyl)amino]-1H-quinoline-3-carbonitrile Formula: C26H23ClN4O MolecularWeight: 442.94002

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N(CC2=CC3=CC=CC=C3C=C2)C4=C(C(=O)NC5=C4C=C(C=C5)Cl)C#N

Isomeric SMILES

C1CNCCC1N(CC2=CC3=CC=CC=C3C=C2)C4=C(C(=O)NC5=C4C=C(C=C5)Cl)C#N

InChI

InChI=1S/C26H23ClN4O/c27-20-7-8-24-22(14-20)25(23(15-28)26(32)30-24)31(21-9-11-29-12-10-21)16-17-5-6-18-3-1-2-4-19(18)13-17/h1-8,13-14,21,29H,9-12,16H2,(H,30,32)