ethyl 4-methyl-2-[(3-oxidanylidenepiperazin-1-yl)methyl]quinoline-3-carboxylate

Systemtic Name: ethyl 4-methyl-2-[(3-oxidanylidenepiperazin-1-yl)methyl]quinoline-3-carboxylate Openeye Name: ethyl 4-methyl-2-[(3-oxopiperazin-1-yl)methyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[(3-oxo-1-piperazinyl)methyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[(3-oxopiperazin-1-yl)methyl]quinoline-3-carboxylate Traditional Name: 2-[(3-ketopiperazino)methyl]-4-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1CN3CCNC(=O)C3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1CN3CCNC(=O)C3)C

InChI

InChI=1S/C18H21N3O3/c1-3-24-18(23)17-12(2)13-6-4-5-7-14(13)20-15(17)10-21-9-8-19-16(22)11-21/h4-7H,3,8-11H2,1-2H3,(H,19,22)