7-methoxy-4-[[7-(4-methoxybut-1-ynyl)-1,3-benzodioxol-4-yl]amino]-5-(1-methylpiperidin-4-yl)oxy-quinoline-3-carbonitrile

Systemtic Name: 7-methoxy-4-[[7-(4-methoxybut-1-ynyl)-1,3-benzodioxol-4-yl]amino]-5-(1-methylpiperidin-4-yl)oxy-quinoline-3-carbonitrile Openeye Name: 7-methoxy-4-[[7-(4-methoxybut-1-ynyl)-1,3-benzodioxol-4-yl]amino]-5-[(1-methyl-4-piperidyl)oxy]quinoline-3-carbonitrile CAS Name: 7-methoxy-4-[[7-(4-methoxybut-1-ynyl)-1,3-benzodioxol-4-yl]amino]-5-[(1-methyl-4-piperidinyl)oxy]-3-quinolinecarbonitrile IUPAC Name: 7-methoxy-4-[[7-(4-methoxybut-1-ynyl)-1,3-benzodioxol-4-yl]amino]-5-(1-methylpiperidin-4-yl)oxyquinoline-3-carbonitrile Traditional Name: 7-methoxy-4-[[7-(4-methoxybut-1-ynyl)-1,3-benzodioxol-4-yl]amino]-5-[(1-methyl-4-piperidyl)oxy]quinoline-3-carbonitrile Formula: C29H30N4O5 MolecularWeight: 514.5723

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)OC2=C3C(=CC(=C2)OC)N=CC(=C3NC4=C5C(=C(C=C4)C#CCCOC)OCO5)C#N

Isomeric SMILES

CN1CCC(CC1)OC2=C3C(=CC(=C2)OC)N=CC(=C3NC4=C5C(=C(C=C4)C#CCCOC)OCO5)C#N

InChI

InChI=1S/C29H30N4O5/c1-33-11-9-21(10-12-33)38-25-15-22(35-3)14-24-26(25)27(20(16-30)17-31-24)32-23-8-7-19(6-4-5-13-34-2)28-29(23)37-18-36-28/h7-8,14-15,17,21H,5,9-13,18H2,1-3H3,(H,31,32)