ethyl 2-[2-methanoyl-4-[4-(phenylmethyl)piperazin-1-yl]phenoxy]ethanoate

Systemtic Name: ethyl 2-[2-methanoyl-4-[4-(phenylmethyl)piperazin-1-yl]phenoxy]ethanoate Openeye Name: ethyl 2-[4-(4-benzylpiperazin-1-yl)-2-formyl-phenoxy]acetate CAS Name: 2-[2-formyl-4-[4-(phenylmethyl)-1-piperazinyl]phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-benzylpiperazin-1-yl)-2-formylphenoxy]acetate Traditional Name: 2-[4-(4-benzylpiperazino)-2-formyl-phenoxy]acetic acid ethyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=C(C=C1)N2CCN(CC2)CC3=CC=CC=C3)C=O

Isomeric SMILES

CCOC(=O)COC1=C(C=C(C=C1)N2CCN(CC2)CC3=CC=CC=C3)C=O

InChI

InChI=1S/C22H26N2O4/c1-2-27-22(26)17-28-21-9-8-20(14-19(21)16-25)24-12-10-23(11-13-24)15-18-6-4-3-5-7-18/h3-9,14,16H,2,10-13,15,17H2,1H3