2-(4-pyridin-2-ylpiperazin-1-yl)ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: 2-(4-pyridin-2-ylpiperazin-1-yl)ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: 2-[4-(2-pyridyl)piperazin-1-yl]ethyl 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid 2-[4-(2-pyridinyl)-1-piperazinyl]ethyl ester IUPAC Name: 2-(4-pyridin-2-ylpiperazin-1-yl)ethyl 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid 2-[4-(2-pyridyl)piperazino]ethyl ester Formula: C19H23ClN4O3 MolecularWeight: 390.86392

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCCN2CCN(CC2)C3=CC=CC=N3)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCCN2CCN(CC2)C3=CC=CC=N3)Cl)N

InChI

InChI=1S/C19H23ClN4O3/c1-26-17-13-16(21)15(20)12-14(17)19(25)27-11-10-23-6-8-24(9-7-23)18-4-2-3-5-22-18/h2-5,12-13H,6-11,21H2,1H3