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

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-(2-dimethylaminoethyl)-4-oxidanylidene-6-(3-oxidanylprop-1-ynyl)quinoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-1-(2-dimethylaminoethyl)-6-(3-hydroxyprop-1-ynyl)-4-oxo-quinoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-1-(2-dimethylaminoethyl)-6-(3-hydroxyprop-1-ynyl)-4-oxo-3-quinolinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-1-(2-dimethylaminoethyl)-6-(3-hydroxyprop-1-ynyl)-4-oxoquinoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-1-(2-dimethylaminoethyl)-6-(3-hydroxyprop-1-ynyl)-4-keto-quinoline-3-carboxamide Formula: C24H24ClN3O3 MolecularWeight: 437.91866

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C=C(C(=O)C2=C1C=CC(=C2)C#CCO)C(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

CN(C)CCN1C=C(C(=O)C2=C1C=CC(=C2)C#CCO)C(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H24ClN3O3/c1-27(2)11-12-28-16-21(24(31)26-15-18-5-8-19(25)9-6-18)23(30)20-14-17(4-3-13-29)7-10-22(20)28/h5-10,14,16,29H,11-13,15H2,1-2H3,(H,26,31)