ethyl 4-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]carbonylbenzoate

Systemtic Name: ethyl 4-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]carbonylbenzoate Openeye Name: ethyl 4-[3-[(4-methylpiperazin-1-yl)methyl]benzoyl]benzoate CAS Name: 4-[[3-[(4-methyl-1-piperazinyl)methyl]phenyl]-oxomethyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-[(4-methylpiperazin-1-yl)methyl]benzoyl]benzoate Traditional Name: 4-[3-[(4-methylpiperazino)methyl]benzoyl]benzoic acid ethyl ester Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)CN3CCN(CC3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)CN3CCN(CC3)C

InChI

InChI=1S/C22H26N2O3/c1-3-27-22(26)19-9-7-18(8-10-19)21(25)20-6-4-5-17(15-20)16-24-13-11-23(2)12-14-24/h4-10,15H,3,11-14,16H2,1-2H3