2-hydroxyethyl 2-azanyl-3-bromanyl-5-[[cyclohexyl(ethyl)amino]methyl]benzoate

Systemtic Name: 2-hydroxyethyl 2-azanyl-3-bromanyl-5-[[cyclohexyl(ethyl)amino]methyl]benzoate Openeye Name: 2-hydroxyethyl 2-amino-3-bromo-5-[[cyclohexyl(ethyl)amino]methyl]benzoate CAS Name: 2-amino-3-bromo-5-[[cyclohexyl(ethyl)amino]methyl]benzoic acid 2-hydroxyethyl ester IUPAC Name: 2-hydroxyethyl 2-amino-3-bromo-5-[[cyclohexyl(ethyl)amino]methyl]benzoate Traditional Name: 2-amino-3-bromo-5-[[cyclohexyl(ethyl)amino]methyl]benzoic acid 2-hydroxyethyl ester Formula: C18H27BrN2O3 MolecularWeight: 399.32258

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C(=C1)C(=O)OCCO)N)Br)C2CCCCC2

Isomeric SMILES

CCN(CC1=CC(=C(C(=C1)C(=O)OCCO)N)Br)C2CCCCC2

InChI

InChI=1S/C18H27BrN2O3/c1-2-21(14-6-4-3-5-7-14)12-13-10-15(17(20)16(19)11-13)18(23)24-9-8-22/h10-11,14,22H,2-9,12,20H2,1H3