4-[(2,3-dimethyl-1H-indol-5-yl)oxy]-7-[3-(4-methylpiperazin-1-yl)propoxy]quinoline-6-carbonitrile

Systemtic Name: 4-[(2,3-dimethyl-1H-indol-5-yl)oxy]-7-[3-(4-methylpiperazin-1-yl)propoxy]quinoline-6-carbonitrile Openeye Name: 4-[(2,3-dimethyl-1H-indol-5-yl)oxy]-7-[3-(4-methylpiperazin-1-yl)propoxy]quinoline-6-carbonitrile CAS Name: 4-[(2,3-dimethyl-1H-indol-5-yl)oxy]-7-[3-(4-methyl-1-piperazinyl)propoxy]-6-quinolinecarbonitrile IUPAC Name: 4-[(2,3-dimethyl-1H-indol-5-yl)oxy]-7-[3-(4-methylpiperazin-1-yl)propoxy]quinoline-6-carbonitrile Traditional Name: 4-[(2,3-dimethyl-1H-indol-5-yl)oxy]-7-[3-(4-methylpiperazino)propoxy]quinoline-6-carbonitrile Formula: C28H31N5O2 MolecularWeight: 469.57804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)OC3=C4C=C(C(=CC4=NC=C3)OCCCN5CCN(CC5)C)C#N)C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)OC3=C4C=C(C(=CC4=NC=C3)OCCCN5CCN(CC5)C)C#N)C

InChI

InChI=1S/C28H31N5O2/c1-19-20(2)31-25-6-5-22(16-23(19)25)35-27-7-8-30-26-17-28(21(18-29)15-24(26)27)34-14-4-9-33-12-10-32(3)11-13-33/h5-8,15-17,31H,4,9-14H2,1-3H3