N-[(1R)-2-(cyclohexylamino)-2-oxidanylidene-1-quinolin-6-yl-ethyl]-N-(furan-2-ylmethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Systemtic Name: N-[(1R)-2-(cyclohexylamino)-2-oxidanylidene-1-quinolin-6-yl-ethyl]-N-(furan-2-ylmethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[(1R)-2-(cyclohexylamino)-2-oxo-1-(6-quinolyl)ethyl]-N-(2-furylmethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[(1R)-2-(cyclohexylamino)-2-oxo-1-(6-quinolinyl)ethyl]-N-(2-furanylmethyl)-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-[(1R)-2-(cyclohexylamino)-2-oxo-1-quinolin-6-ylethyl]-N-(furan-2-ylmethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[(1R)-2-(cyclohexylamino)-2-keto-1-(6-quinolyl)ethyl]-N-(2-furfuryl)-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C31H31N3O5 MolecularWeight: 525.59494

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CC3=C(C=C2)N=CC=C3)N(CC4=CC=CO4)C(=O)C5=CC6=C(C=C5)OCCO6

Isomeric SMILES

C1CCC(CC1)NC(=O)[C@@H](C2=CC3=C(C=C2)N=CC=C3)N(CC4=CC=CO4)C(=O)C5=CC6=C(C=C5)OCCO6

InChI

InChI=1S/C31H31N3O5/c35-30(33-24-7-2-1-3-8-24)29(22-10-12-26-21(18-22)6-4-14-32-26)34(20-25-9-5-15-37-25)31(36)23-11-13-27-28(19-23)39-17-16-38-27/h4-6,9-15,18-19,24,29H,1-3,7-8,16-17,20H2,(H,33,35)/t29-/m1/s1