2-hydroxyethyl 4-azanyl-3-bromanyl-5-[(4-methylpiperazin-1-yl)methyl]benzoate

Systemtic Name: 2-hydroxyethyl 4-azanyl-3-bromanyl-5-[(4-methylpiperazin-1-yl)methyl]benzoate Openeye Name: 2-hydroxyethyl 4-amino-3-bromo-5-[(4-methylpiperazin-1-yl)methyl]benzoate CAS Name: 4-amino-3-bromo-5-[(4-methyl-1-piperazinyl)methyl]benzoic acid 2-hydroxyethyl ester IUPAC Name: 2-hydroxyethyl 4-amino-3-bromo-5-[(4-methylpiperazin-1-yl)methyl]benzoate Traditional Name: 4-amino-3-bromo-5-[(4-methylpiperazino)methyl]benzoic acid 2-hydroxyethyl ester Formula: C15H22BrN3O3 MolecularWeight: 372.25748

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=C(C(=CC(=C2)C(=O)OCCO)Br)N

Isomeric SMILES

CN1CCN(CC1)CC2=C(C(=CC(=C2)C(=O)OCCO)Br)N

InChI

InChI=1S/C15H22BrN3O3/c1-18-2-4-19(5-3-18)10-12-8-11(9-13(16)14(12)17)15(21)22-7-6-20/h8-9,20H,2-7,10,17H2,1H3