N-[(4-chlorophenyl)methyl]-6-(oxan-4-yl)-4-oxidanylidene-8-[4-(2-oxidanylidene-1,3-oxazolidin-4-yl)but-1-ynyl]-1H-cinnoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-6-(oxan-4-yl)-4-oxidanylidene-8-[4-(2-oxidanylidene-1,3-oxazolidin-4-yl)but-1-ynyl]-1H-cinnoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-4-oxo-8-[4-(2-oxooxazolidin-4-yl)but-1-ynyl]-6-tetrahydropyran-4-yl-1H-cinnoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-6-(4-oxanyl)-4-oxo-8-[4-(2-oxo-4-oxazolidinyl)but-1-ynyl]-1H-cinnoline-3-carboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-6-(oxan-4-yl)-4-oxo-8-[4-(2-oxo-1,3-oxazolidin-4-yl)but-1-ynyl]-1H-cinnoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-4-keto-8-[4-(2-ketooxazolidin-4-yl)but-1-ynyl]-6-tetrahydropyran-4-yl-1H-cinnoline-3-carboxamide Formula: C28H27ClN4O5 MolecularWeight: 534.99078

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1C2=CC3=C(C(=C2)C#CCCC4COC(=O)N4)NN=C(C3=O)C(=O)NCC5=CC=C(C=C5)Cl

Isomeric SMILES

C1COCCC1C2=CC3=C(C(=C2)C#CCCC4COC(=O)N4)NN=C(C3=O)C(=O)NCC5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H27ClN4O5/c29-21-7-5-17(6-8-21)15-30-27(35)25-26(34)23-14-20(18-9-11-37-12-10-18)13-19(24(23)32-33-25)3-1-2-4-22-16-38-28(36)31-22/h5-8,13-14,18,22H,2,4,9-12,15-16H2,(H,30,35)(H,31,36)(H,32,34)