methyl 3-oxidanyl-2-[1-(4-phenylpiperazin-1-yl)propan-2-ylamino]benzoate

Systemtic Name: methyl 3-oxidanyl-2-[1-(4-phenylpiperazin-1-yl)propan-2-ylamino]benzoate Openeye Name: methyl 3-hydroxy-2-[[1-methyl-2-(4-phenylpiperazin-1-yl)ethyl]amino]benzoate CAS Name: 3-hydroxy-2-[1-(4-phenyl-1-piperazinyl)propan-2-ylamino]benzoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-[1-(4-phenylpiperazin-1-yl)propan-2-ylamino]benzoate Traditional Name: 3-hydroxy-2-[[1-methyl-2-(4-phenylpiperazino)ethyl]amino]benzoic acid methyl ester Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCN(CC1)C2=CC=CC=C2)NC3=C(C=CC=C3O)C(=O)OC

Isomeric SMILES

CC(CN1CCN(CC1)C2=CC=CC=C2)NC3=C(C=CC=C3O)C(=O)OC

InChI

InChI=1S/C21H27N3O3/c1-16(22-20-18(21(26)27-2)9-6-10-19(20)25)15-23-11-13-24(14-12-23)17-7-4-3-5-8-17/h3-10,16,22,25H,11-15H2,1-2H3