3-cyclohexyl-N5-[(3,4,5-trimethoxyphenyl)methyl]quinoline-2,4,5-triamine

Systemtic Name: 3-cyclohexyl-N5-[(3,4,5-trimethoxyphenyl)methyl]quinoline-2,4,5-triamine Openeye Name: 3-cyclohexyl-N5-[(3,4,5-trimethoxyphenyl)methyl]quinoline-2,4,5-triamine CAS Name: 3-cyclohexyl-N5-[(3,4,5-trimethoxyphenyl)methyl]quinoline-2,4,5-triamine IUPAC Name: 3-cyclohexyl-5-N-[(3,4,5-trimethoxyphenyl)methyl]quinoline-2,4,5-triamine Traditional Name: (2,4-diamino-3-cyclohexyl-5-quinolyl)-(3,4,5-trimethoxybenzyl)amine Formula: C25H32N4O3 MolecularWeight: 436.54658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC2=CC=CC3=C2C(=C(C(=N3)N)C4CCCCC4)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC2=CC=CC3=C2C(=C(C(=N3)N)C4CCCCC4)N

InChI

InChI=1S/C25H32N4O3/c1-30-19-12-15(13-20(31-2)24(19)32-3)14-28-17-10-7-11-18-22(17)23(26)21(25(27)29-18)16-8-5-4-6-9-16/h7,10-13,16,28H,4-6,8-9,14H2,1-3H3,(H4,26,27,29)