2-hydroxyethyl 4-azanyl-3-bromanyl-5-[(cyclohexylmethylamino)methyl]benzoate

Systemtic Name: 2-hydroxyethyl 4-azanyl-3-bromanyl-5-[(cyclohexylmethylamino)methyl]benzoate Openeye Name: 2-hydroxyethyl 4-amino-3-bromo-5-[(cyclohexylmethylamino)methyl]benzoate CAS Name: 4-amino-3-bromo-5-[(cyclohexylmethylamino)methyl]benzoic acid 2-hydroxyethyl ester IUPAC Name: 2-hydroxyethyl 4-amino-3-bromo-5-[(cyclohexylmethylamino)methyl]benzoate Traditional Name: 4-amino-3-bromo-5-[(cyclohexylmethylamino)methyl]benzoic acid 2-hydroxyethyl ester Formula: C17H25BrN2O3 MolecularWeight: 385.296

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNCC2=C(C(=CC(=C2)C(=O)OCCO)Br)N

Isomeric SMILES

C1CCC(CC1)CNCC2=C(C(=CC(=C2)C(=O)OCCO)Br)N

InChI

InChI=1S/C17H25BrN2O3/c18-15-9-13(17(22)23-7-6-21)8-14(16(15)19)11-20-10-12-4-2-1-3-5-12/h8-9,12,20-21H,1-7,10-11,19H2