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

Systemtic Name: 7-ethoxy-6-methoxy-4-[[7-(3-methoxyprop-1-ynyl)-1,3-benzodioxol-4-yl]amino]quinoline-3-carbonitrile hydrochloride Openeye Name: 7-ethoxy-6-methoxy-4-[[7-(3-methoxyprop-1-ynyl)-1,3-benzodioxol-4-yl]amino]quinoline-3-carbonitrile hydrochloride CAS Name: 7-ethoxy-6-methoxy-4-[[7-(3-methoxyprop-1-ynyl)-1,3-benzodioxol-4-yl]amino]-3-quinolinecarbonitrile hydrochloride IUPAC Name: 7-ethoxy-6-methoxy-4-[[7-(3-methoxyprop-1-ynyl)-1,3-benzodioxol-4-yl]amino]quinoline-3-carbonitrile hydrochloride Traditional Name: 7-ethoxy-6-methoxy-4-[[7-(3-methoxyprop-1-ynyl)-1,3-benzodioxol-4-yl]amino]quinoline-3-carbonitrile hydrochloride Formula: C24H22ClN3O5 MolecularWeight: 467.90158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=C4C(=C(C=C3)C#CCOC)OCO4)C#N)OC.Cl

Isomeric SMILES

CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=C4C(=C(C=C3)C#CCOC)OCO4)C#N)OC.Cl

InChI

InChI=1S/C24H21N3O5.ClH/c1-4-30-21-11-19-17(10-20(21)29-3)22(16(12-25)13-26-19)27-18-8-7-15(6-5-9-28-2)23-24(18)32-14-31-23;/h7-8,10-11,13H,4,9,14H2,1-3H3,(H,26,27);1H