4-[[4-(furan-3-ylmethyl)phenyl]amino]-7-[4-(piperidin-1-ylmethyl)phenyl]quinoline-3-carbonitrile

Systemtic Name: 4-[[4-(furan-3-ylmethyl)phenyl]amino]-7-[4-(piperidin-1-ylmethyl)phenyl]quinoline-3-carbonitrile Openeye Name: 4-[4-(3-furylmethyl)anilino]-7-[4-(1-piperidylmethyl)phenyl]quinoline-3-carbonitrile CAS Name: 4-[4-(3-furanylmethyl)anilino]-7-[4-(1-piperidinylmethyl)phenyl]-3-quinolinecarbonitrile IUPAC Name: 4-[4-(furan-3-ylmethyl)anilino]-7-[4-(piperidin-1-ylmethyl)phenyl]quinoline-3-carbonitrile Traditional Name: 4-[4-(3-furfuryl)anilino]-7-[4-(piperidinomethyl)phenyl]quinoline-3-carbonitrile Formula: C33H30N4O MolecularWeight: 498.6175

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)C3=CC4=NC=C(C(=C4C=C3)NC5=CC=C(C=C5)CC6=COC=C6)C#N

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)C3=CC4=NC=C(C(=C4C=C3)NC5=CC=C(C=C5)CC6=COC=C6)C#N

InChI

InChI=1S/C33H30N4O/c34-20-29-21-35-32-19-28(27-8-4-25(5-9-27)22-37-15-2-1-3-16-37)10-13-31(32)33(29)36-30-11-6-24(7-12-30)18-26-14-17-38-23-26/h4-14,17,19,21,23H,1-3,15-16,18,22H2,(H,35,36)