3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]carbonyl-6-ethoxy-1-methyl-quinolin-4-one

Systemtic Name: 3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]carbonyl-6-ethoxy-1-methyl-quinolin-4-one Openeye Name: 3-[4-(5-chloro-2-methyl-phenyl)piperazine-1-carbonyl]-6-ethoxy-1-methyl-quinolin-4-one CAS Name: 3-[[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-oxomethyl]-6-ethoxy-1-methyl-4-quinolinone IUPAC Name: 3-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-6-ethoxy-1-methylquinolin-4-one Traditional Name: 3-[4-(5-chloro-2-methyl-phenyl)piperazine-1-carbonyl]-6-ethoxy-1-methyl-4-quinolone Formula: C24H26ClN3O3 MolecularWeight: 439.93454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C=C(C2=O)C(=O)N3CCN(CC3)C4=C(C=CC(=C4)Cl)C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C=C(C2=O)C(=O)N3CCN(CC3)C4=C(C=CC(=C4)Cl)C)C

InChI

InChI=1S/C24H26ClN3O3/c1-4-31-18-7-8-21-19(14-18)23(29)20(15-26(21)3)24(30)28-11-9-27(10-12-28)22-13-17(25)6-5-16(22)2/h5-8,13-15H,4,9-12H2,1-3H3