methyl 4-[[2-methoxy-4-[(4-methylpiperazin-1-yl)iminomethyl]phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[2-methoxy-4-[(4-methylpiperazin-1-yl)iminomethyl]phenoxy]methyl]benzoate Openeye Name: methyl 4-[[2-methoxy-4-[(4-methylpiperazin-1-yl)iminomethyl]phenoxy]methyl]benzoate CAS Name: 4-[[2-methoxy-4-[(4-methyl-1-piperazinyl)iminomethyl]phenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-methoxy-4-[(4-methylpiperazin-1-yl)iminomethyl]phenoxy]methyl]benzoate Traditional Name: 4-[[2-methoxy-4-[(4-methylpiperazino)iminomethyl]phenoxy]methyl]benzoic acid methyl ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)N=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)C(=O)OC)OC

Isomeric SMILES

CN1CCN(CC1)N=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)C(=O)OC)OC

InChI

InChI=1S/C22H27N3O4/c1-24-10-12-25(13-11-24)23-15-18-6-9-20(21(14-18)27-2)29-16-17-4-7-19(8-5-17)22(26)28-3/h4-9,14-15H,10-13,16H2,1-3H3