4-(4-azanyl-3-chloranyl-phenoxy)-7-[3-(diethylamino)-2-oxidanyl-propoxy]quinoline-6-carbonitrile

Systemtic Name: 4-(4-azanyl-3-chloranyl-phenoxy)-7-[3-(diethylamino)-2-oxidanyl-propoxy]quinoline-6-carbonitrile Openeye Name: 4-(4-amino-3-chloro-phenoxy)-7-[3-(diethylamino)-2-hydroxy-propoxy]quinoline-6-carbonitrile CAS Name: 4-(4-amino-3-chlorophenoxy)-7-[3-(diethylamino)-2-hydroxypropoxy]-6-quinolinecarbonitrile IUPAC Name: 4-(4-amino-3-chlorophenoxy)-7-[3-(diethylamino)-2-hydroxypropoxy]quinoline-6-carbonitrile Traditional Name: 4-(4-amino-3-chloro-phenoxy)-7-[3-(diethylamino)-2-hydroxy-propoxy]quinoline-6-carbonitrile Formula: C23H25ClN4O3 MolecularWeight: 440.9226

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(COC1=CC2=NC=CC(=C2C=C1C#N)OC3=CC(=C(C=C3)N)Cl)O

Isomeric SMILES

CCN(CC)CC(COC1=CC2=NC=CC(=C2C=C1C#N)OC3=CC(=C(C=C3)N)Cl)O

InChI

InChI=1S/C23H25ClN4O3/c1-3-28(4-2)13-16(29)14-30-23-11-21-18(9-15(23)12-25)22(7-8-27-21)31-17-5-6-20(26)19(24)10-17/h5-11,16,29H,3-4,13-14,26H2,1-2H3