5-(4-methoxyphenyl)-2-[2-(4-propanoylpiperazin-1-yl)ethyliminomethyl]cyclohexane-1,3-dione

Systemtic Name: 5-(4-methoxyphenyl)-2-[2-(4-propanoylpiperazin-1-yl)ethyliminomethyl]cyclohexane-1,3-dione Openeye Name: 5-(4-methoxyphenyl)-2-[2-(4-propanoylpiperazin-1-yl)ethyliminomethyl]cyclohexane-1,3-dione CAS Name: 5-(4-methoxyphenyl)-2-[2-[4-(1-oxopropyl)-1-piperazinyl]ethyliminomethyl]cyclohexane-1,3-dione IUPAC Name: 5-(4-methoxyphenyl)-2-[2-(4-propanoylpiperazin-1-yl)ethyliminomethyl]cyclohexane-1,3-dione Traditional Name: 5-(4-methoxyphenyl)-2-[2-(4-propionylpiperazino)ethyliminomethyl]cyclohexane-1,3-quinone Formula: C23H31N3O4 MolecularWeight: 413.50994

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)CCN=CC2C(=O)CC(CC2=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCC(=O)N1CCN(CC1)CCN=CC2C(=O)CC(CC2=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H31N3O4/c1-3-23(29)26-12-10-25(11-13-26)9-8-24-16-20-21(27)14-18(15-22(20)28)17-4-6-19(30-2)7-5-17/h4-7,16,18,20H,3,8-15H2,1-2H3