5-[4-[4-(5-isocyano-1-methyl-indol-3-yl)cyclohexyl]piperazin-1-yl]quinoline

Systemtic Name: 5-[4-[4-(5-isocyano-1-methyl-indol-3-yl)cyclohexyl]piperazin-1-yl]quinoline Openeye Name: 5-[4-[4-(5-isocyano-1-methyl-indol-3-yl)cyclohexyl]piperazin-1-yl]quinoline CAS Name: 5-[4-[4-(5-isocyano-1-methyl-3-indolyl)cyclohexyl]-1-piperazinyl]quinoline IUPAC Name: 5-[4-[4-(5-isocyano-1-methylindol-3-yl)cyclohexyl]piperazin-1-yl]quinoline Traditional Name: 5-[4-[4-(5-isocyano-1-methyl-indol-3-yl)cyclohexyl]piperazino]quinoline Formula: C29H31N5 MolecularWeight: 449.58994

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)[N+]#[C-])C3CCC(CC3)N4CCN(CC4)C5=CC=CC6=C5C=CC=N6

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)[N+]#[C-])C3CCC(CC3)N4CCN(CC4)C5=CC=CC6=C5C=CC=N6

InChI

InChI=1S/C29H31N5/c1-30-22-10-13-28-25(19-22)26(20-32(28)2)21-8-11-23(12-9-21)33-15-17-34(18-16-33)29-7-3-6-27-24(29)5-4-14-31-27/h3-7,10,13-14,19-21,23H,8-9,11-12,15-18H2,2H3