methyl 4-[2-methoxy-4-[3-(4-methylpiperazin-1-yl)-3-oxidanylidene-propyl]phenyl]benzoate

Systemtic Name: methyl 4-[2-methoxy-4-[3-(4-methylpiperazin-1-yl)-3-oxidanylidene-propyl]phenyl]benzoate Openeye Name: methyl 4-[2-methoxy-4-[3-(4-methylpiperazin-1-yl)-3-oxo-propyl]phenyl]benzoate CAS Name: 4-[2-methoxy-4-[3-(4-methyl-1-piperazinyl)-3-oxopropyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-methoxy-4-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]phenyl]benzoate Traditional Name: 4-[4-[3-keto-3-(4-methylpiperazino)propyl]-2-methoxy-phenyl]benzoic acid methyl ester Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CCC2=CC(=C(C=C2)C3=CC=C(C=C3)C(=O)OC)OC

Isomeric SMILES

CN1CCN(CC1)C(=O)CCC2=CC(=C(C=C2)C3=CC=C(C=C3)C(=O)OC)OC

InChI

InChI=1S/C23H28N2O4/c1-24-12-14-25(15-13-24)22(26)11-5-17-4-10-20(21(16-17)28-2)18-6-8-19(9-7-18)23(27)29-3/h4,6-10,16H,5,11-15H2,1-3H3