6-methoxy-2-methyl-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]quinoline-3-carboxamide

Systemtic Name: 6-methoxy-2-methyl-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]quinoline-3-carboxamide Openeye Name: 6-methoxy-2-methyl-N-[4-(3-oxopiperazin-1-yl)phenyl]quinoline-3-carboxamide CAS Name: 6-methoxy-2-methyl-N-[4-(3-oxo-1-piperazinyl)phenyl]-3-quinolinecarboxamide IUPAC Name: 6-methoxy-2-methyl-N-[4-(3-oxopiperazin-1-yl)phenyl]quinoline-3-carboxamide Traditional Name: N-[4-(3-ketopiperazino)phenyl]-6-methoxy-2-methyl-quinoline-3-carboxamide Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=C(C=CC2=N1)OC)C(=O)NC3=CC=C(C=C3)N4CCNC(=O)C4

Isomeric SMILES

CC1=C(C=C2C=C(C=CC2=N1)OC)C(=O)NC3=CC=C(C=C3)N4CCNC(=O)C4

InChI

InChI=1S/C22H22N4O3/c1-14-19(12-15-11-18(29-2)7-8-20(15)24-14)22(28)25-16-3-5-17(6-4-16)26-10-9-23-21(27)13-26/h3-8,11-12H,9-10,13H2,1-2H3,(H,23,27)(H,25,28)