4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6-ethoxy-quinoline-3-carbonitrile hydrochloride

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6-ethoxy-quinoline-3-carbonitrile hydrochloride Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6-ethoxy-quinoline-3-carbonitrile hydrochloride CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6-ethoxy-3-quinolinecarbonitrile hydrochloride IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6-ethoxyquinoline-3-carbonitrile hydrochloride Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6-ethoxy-quinoline-3-carbonitrile hydrochloride Formula: C20H18ClN3O3 MolecularWeight: 383.82822

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C(=CN=C2C=C1)C#N)NC3=CC4=C(C=C3)OCCO4.Cl

Isomeric SMILES

CCOC1=CC2=C(C(=CN=C2C=C1)C#N)NC3=CC4=C(C=C3)OCCO4.Cl

InChI

InChI=1S/C20H17N3O3.ClH/c1-2-24-15-4-5-17-16(10-15)20(13(11-21)12-22-17)23-14-3-6-18-19(9-14)26-8-7-25-18;/h3-6,9-10,12H,2,7-8H2,1H3,(H,22,23);1H