5-oxidanylpentyl 4-azanyl-3-bromanyl-5-(morpholin-4-ylmethyl)benzoate

Systemtic Name: 5-oxidanylpentyl 4-azanyl-3-bromanyl-5-(morpholin-4-ylmethyl)benzoate Openeye Name: 5-hydroxypentyl 4-amino-3-bromo-5-(morpholinomethyl)benzoate CAS Name: 4-amino-3-bromo-5-(4-morpholinylmethyl)benzoic acid 5-hydroxypentyl ester IUPAC Name: 5-hydroxypentyl 4-amino-3-bromo-5-(morpholin-4-ylmethyl)benzoate Traditional Name: 4-amino-3-bromo-5-(morpholinomethyl)benzoic acid 5-hydroxypentyl ester Formula: C17H25BrN2O4 MolecularWeight: 401.2954

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=C(C(=CC(=C2)C(=O)OCCCCCO)Br)N

Isomeric SMILES

C1COCCN1CC2=C(C(=CC(=C2)C(=O)OCCCCCO)Br)N

InChI

InChI=1S/C17H25BrN2O4/c18-15-11-13(17(22)24-7-3-1-2-6-21)10-14(16(15)19)12-20-4-8-23-9-5-20/h10-11,21H,1-9,12,19H2