methyl 5-oxidanyl-2-[2-(4-phenylpiperazin-1-yl)ethylamino]benzoate

Systemtic Name: methyl 5-oxidanyl-2-[2-(4-phenylpiperazin-1-yl)ethylamino]benzoate Openeye Name: methyl 5-hydroxy-2-[2-(4-phenylpiperazin-1-yl)ethylamino]benzoate CAS Name: 5-hydroxy-2-[2-(4-phenyl-1-piperazinyl)ethylamino]benzoic acid methyl ester IUPAC Name: methyl 5-hydroxy-2-[2-(4-phenylpiperazin-1-yl)ethylamino]benzoate Traditional Name: 5-hydroxy-2-[2-(4-phenylpiperazino)ethylamino]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)NCCN2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)O)NCCN2CCN(CC2)C3=CC=CC=C3

InChI

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