1-[3-(3,5-dimethylmorpholin-4-yl)pentyl]-5-oxidanylidene-2-quinolin-3-yl-cyclohex-3-ene-1-carboximidamide

Systemtic Name: 1-[3-(3,5-dimethylmorpholin-4-yl)pentyl]-5-oxidanylidene-2-quinolin-3-yl-cyclohex-3-ene-1-carboximidamide Openeye Name: 1-[3-(3,5-dimethylmorpholin-4-yl)pentyl]-5-oxo-2-(3-quinolyl)cyclohex-3-ene-1-carboxamidine CAS Name: 1-[3-(3,5-dimethyl-4-morpholinyl)pentyl]-5-oxo-2-(3-quinolinyl)-1-cyclohex-3-enecarboximidamide IUPAC Name: 1-[3-(3,5-dimethylmorpholin-4-yl)pentyl]-5-oxo-2-quinolin-3-ylcyclohex-3-ene-1-carboximidamide Traditional Name: 1-[3-(3,5-dimethylmorpholino)pentyl]-5-keto-2-(3-quinolyl)cyclohex-3-ene-1-carboxamidine Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1(CC(=O)C=CC1C2=CC3=CC=CC=C3N=C2)C(=N)N)N4C(COCC4C)C

Isomeric SMILES

CCC(CCC1(CC(=O)C=CC1C2=CC3=CC=CC=C3N=C2)C(=N)N)N4C(COCC4C)C

InChI

InChI=1S/C27H36N4O2/c1-4-22(31-18(2)16-33-17-19(31)3)11-12-27(26(28)29)14-23(32)9-10-24(27)21-13-20-7-5-6-8-25(20)30-15-21/h5-10,13,15,18-19,22,24H,4,11-12,14,16-17H2,1-3H3,(H3,28,29)