4-[[3-(diethylaminocarbamoyl)-6-hexanoyl-8-methoxy-2-piperidin-4-yl-quinolin-4-yl]amino]-N-[1-(phenylmethyl)piperidin-4-yl]benzamide

Systemtic Name: 4-[[3-(diethylaminocarbamoyl)-6-hexanoyl-8-methoxy-2-piperidin-4-yl-quinolin-4-yl]amino]-N-[1-(phenylmethyl)piperidin-4-yl]benzamide Openeye Name: N-(1-benzyl-4-piperidyl)-4-[[3-(diethylaminocarbamoyl)-6-hexanoyl-8-methoxy-2-(4-piperidyl)-4-quinolyl]amino]benzamide CAS Name: 4-[[3-[(2,2-diethylhydrazinyl)-oxomethyl]-8-methoxy-6-(1-oxohexyl)-2-(4-piperidinyl)-4-quinolinyl]amino]-N-[1-(phenylmethyl)-4-piperidinyl]benzamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-4-[[3-(diethylaminocarbamoyl)-6-hexanoyl-8-methoxy-2-piperidin-4-ylquinolin-4-yl]amino]benzamide Traditional Name: N-(1-benzyl-4-piperidyl)-4-[[6-caproyl-3-(diethylaminocarbamoyl)-8-methoxy-2-(4-piperidyl)-4-quinolyl]amino]benzamide Formula: C45H59N7O4 MolecularWeight: 761.99446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1=CC(=C2C(=C1)C(=C(C(=N2)C3CCNCC3)C(=O)NN(CC)CC)NC4=CC=C(C=C4)C(=O)NC5CCN(CC5)CC6=CC=CC=C6)OC

Isomeric SMILES

CCCCCC(=O)C1=CC(=C2C(=C1)C(=C(C(=N2)C3CCNCC3)C(=O)NN(CC)CC)NC4=CC=C(C=C4)C(=O)NC5CCN(CC5)CC6=CC=CC=C6)OC

InChI

InChI=1S/C45H59N7O4/c1-5-8-10-15-38(53)34-28-37-42(39(29-34)56-4)49-41(32-20-24-46-25-21-32)40(45(55)50-52(6-2)7-3)43(37)47-35-18-16-33(17-19-35)44(54)48-36-22-26-51(27-23-36)30-31-13-11-9-12-14-31/h9,11-14,16-19,28-29,32,36,46H,5-8,10,15,20-27,30H2,1-4H3,(H,47,49)(H,48,54)(H,50,55)