7-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]-4-[(3,4,5-trimethoxyphenyl)amino]quinoline-3-carbonitrile

Systemtic Name: 7-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]-4-[(3,4,5-trimethoxyphenyl)amino]quinoline-3-carbonitrile Openeye Name: 7-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]-4-(3,4,5-trimethoxyanilino)quinoline-3-carbonitrile CAS Name: 7-[4-[(4-ethyl-1-piperazinyl)methyl]phenyl]-4-(3,4,5-trimethoxyanilino)-3-quinolinecarbonitrile IUPAC Name: 7-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]-4-(3,4,5-trimethoxyanilino)quinoline-3-carbonitrile Traditional Name: 7-[4-[(4-ethylpiperazino)methyl]phenyl]-4-(3,4,5-trimethoxyanilino)quinoline-3-carbonitrile Formula: C32H35N5O3 MolecularWeight: 537.652

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=CC=C(C=C2)C3=CC4=NC=C(C(=C4C=C3)NC5=CC(=C(C(=C5)OC)OC)OC)C#N

Isomeric SMILES

CCN1CCN(CC1)CC2=CC=C(C=C2)C3=CC4=NC=C(C(=C4C=C3)NC5=CC(=C(C(=C5)OC)OC)OC)C#N

InChI

InChI=1S/C32H35N5O3/c1-5-36-12-14-37(15-13-36)21-22-6-8-23(9-7-22)24-10-11-27-28(16-24)34-20-25(19-33)31(27)35-26-17-29(38-2)32(40-4)30(18-26)39-3/h6-11,16-18,20H,5,12-15,21H2,1-4H3,(H,34,35)