N-[(4-chlorophenyl)methyl]-1-(2-morpholin-4-ylethyl)-4-oxidanylidene-6-(3-oxidanylprop-1-ynyl)quinoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-(2-morpholin-4-ylethyl)-4-oxidanylidene-6-(3-oxidanylprop-1-ynyl)quinoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-6-(3-hydroxyprop-1-ynyl)-1-(2-morpholinoethyl)-4-oxo-quinoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-6-(3-hydroxyprop-1-ynyl)-1-[2-(4-morpholinyl)ethyl]-4-oxo-3-quinolinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-6-(3-hydroxyprop-1-ynyl)-1-(2-morpholin-4-ylethyl)-4-oxoquinoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-6-(3-hydroxyprop-1-ynyl)-4-keto-1-(2-morpholinoethyl)quinoline-3-carboxamide Formula: C26H26ClN3O4 MolecularWeight: 479.95534

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCN2C=C(C(=O)C3=C2C=CC(=C3)C#CCO)C(=O)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1COCCN1CCN2C=C(C(=O)C3=C2C=CC(=C3)C#CCO)C(=O)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H26ClN3O4/c27-21-6-3-20(4-7-21)17-28-26(33)23-18-30(10-9-29-11-14-34-15-12-29)24-8-5-19(2-1-13-31)16-22(24)25(23)32/h3-8,16,18,31H,9-15,17H2,(H,28,33)