methyl 5-oxidanyl-2-[phenethyl(piperazin-1-yl)amino]benzoate

Systemtic Name: methyl 5-oxidanyl-2-[phenethyl(piperazin-1-yl)amino]benzoate Openeye Name: methyl 5-hydroxy-2-[phenethyl(piperazin-1-yl)amino]benzoate CAS Name: 5-hydroxy-2-[phenethyl(1-piperazinyl)amino]benzoic acid methyl ester IUPAC Name: methyl 5-hydroxy-2-[phenethyl(piperazin-1-yl)amino]benzoate Traditional Name: 5-hydroxy-2-[phenethyl(piperazino)amino]benzoic acid methyl ester Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)O)N(CCC2=CC=CC=C2)N3CCNCC3

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)O)N(CCC2=CC=CC=C2)N3CCNCC3

InChI

InChI=1S/C20H25N3O3/c1-26-20(25)18-15-17(24)7-8-19(18)23(22-13-10-21-11-14-22)12-9-16-5-3-2-4-6-16/h2-8,15,21,24H,9-14H2,1H3