7-[3-(4-ethanoylpiperazin-1-yl)propoxy]-6-methoxy-4-[[7-(3-methoxyprop-1-ynyl)-1,3-benzodioxol-4-yl]amino]quinoline-3-carbonitrile

Systemtic Name: 7-[3-(4-ethanoylpiperazin-1-yl)propoxy]-6-methoxy-4-[[7-(3-methoxyprop-1-ynyl)-1,3-benzodioxol-4-yl]amino]quinoline-3-carbonitrile Openeye Name: 7-[3-(4-acetylpiperazin-1-yl)propoxy]-6-methoxy-4-[[7-(3-methoxyprop-1-ynyl)-1,3-benzodioxol-4-yl]amino]quinoline-3-carbonitrile CAS Name: 7-[3-(4-acetyl-1-piperazinyl)propoxy]-6-methoxy-4-[[7-(3-methoxyprop-1-ynyl)-1,3-benzodioxol-4-yl]amino]-3-quinolinecarbonitrile IUPAC Name: 7-[3-(4-acetylpiperazin-1-yl)propoxy]-6-methoxy-4-[[7-(3-methoxyprop-1-ynyl)-1,3-benzodioxol-4-yl]amino]quinoline-3-carbonitrile Traditional Name: 7-[3-(4-acetylpiperazino)propoxy]-6-methoxy-4-[[7-(3-methoxyprop-1-ynyl)-1,3-benzodioxol-4-yl]amino]quinoline-3-carbonitrile Formula: C31H33N5O6 MolecularWeight: 571.62362

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)CCCOC2=C(C=C3C(=C2)N=CC(=C3NC4=C5C(=C(C=C4)C#CCOC)OCO5)C#N)OC

Isomeric SMILES

CC(=O)N1CCN(CC1)CCCOC2=C(C=C3C(=C2)N=CC(=C3NC4=C5C(=C(C=C4)C#CCOC)OCO5)C#N)OC

InChI

InChI=1S/C31H33N5O6/c1-21(37)36-12-10-35(11-13-36)9-5-15-40-28-17-26-24(16-27(28)39-3)29(23(18-32)19-33-26)34-25-8-7-22(6-4-14-38-2)30-31(25)42-20-41-30/h7-8,16-17,19H,5,9-15,20H2,1-3H3,(H,33,34)