ethyl 6-azanyl-7-[4-(4-ethanoylphenyl)piperazin-1-yl]-1-methyl-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 6-azanyl-7-[4-(4-ethanoylphenyl)piperazin-1-yl]-1-methyl-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 7-[4-(4-acetylphenyl)piperazin-1-yl]-6-amino-1-methyl-4-oxo-quinoline-3-carboxylate CAS Name: 7-[4-(4-acetylphenyl)-1-piperazinyl]-6-amino-1-methyl-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-[4-(4-acetylphenyl)piperazin-1-yl]-6-amino-1-methyl-4-oxoquinoline-3-carboxylate Traditional Name: 7-[4-(4-acetylphenyl)piperazino]-6-amino-4-keto-1-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C25H28N4O4 MolecularWeight: 448.51422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)N)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)N)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C)C

InChI

InChI=1S/C25H28N4O4/c1-4-33-25(32)20-15-27(3)22-14-23(21(26)13-19(22)24(20)31)29-11-9-28(10-12-29)18-7-5-17(6-8-18)16(2)30/h5-8,13-15H,4,9-12,26H2,1-3H3