4-[[1-(1-benzofuran-5-ylmethyl)piperidin-4-yl]amino]-6-chloranyl-2-oxidanylidene-1H-quinoline-3-carbonitrile

Systemtic Name: 4-[[1-(1-benzofuran-5-ylmethyl)piperidin-4-yl]amino]-6-chloranyl-2-oxidanylidene-1H-quinoline-3-carbonitrile Openeye Name: 4-[[1-(benzofuran-5-ylmethyl)-4-piperidyl]amino]-6-chloro-2-oxo-1H-quinoline-3-carbonitrile CAS Name: 4-[[1-(5-benzofuranylmethyl)-4-piperidinyl]amino]-6-chloro-2-oxo-1H-quinoline-3-carbonitrile IUPAC Name: 4-[[1-(1-benzofuran-5-ylmethyl)piperidin-4-yl]amino]-6-chloro-2-oxo-1H-quinoline-3-carbonitrile Traditional Name: 4-[[1-(benzofuran-5-ylmethyl)-4-piperidyl]amino]-6-chloro-2-keto-1H-quinoline-3-carbonitrile Formula: C24H21ClN4O2 MolecularWeight: 432.90214

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=C(C(=O)NC3=C2C=C(C=C3)Cl)C#N)CC4=CC5=C(C=C4)OC=C5

Isomeric SMILES

C1CN(CCC1NC2=C(C(=O)NC3=C2C=C(C=C3)Cl)C#N)CC4=CC5=C(C=C4)OC=C5

InChI

InChI=1S/C24H21ClN4O2/c25-17-2-3-21-19(12-17)23(20(13-26)24(30)28-21)27-18-5-8-29(9-6-18)14-15-1-4-22-16(11-15)7-10-31-22/h1-4,7,10-12,18H,5-6,8-9,14H2,(H2,27,28,30)