ethyl 4-(6-azanylhexanoylamino)-3-bromanyl-benzoate

Systemtic Name: ethyl 4-(6-azanylhexanoylamino)-3-bromanyl-benzoate Openeye Name: ethyl 4-(6-aminohexanoylamino)-3-bromo-benzoate CAS Name: 4-[(6-amino-1-oxohexyl)amino]-3-bromobenzoic acid ethyl ester IUPAC Name: ethyl 4-(6-aminohexanoylamino)-3-bromobenzoate Traditional Name: 4-(6-aminohexanoylamino)-3-bromo-benzoic acid ethyl ester Formula: C15H21BrN2O3 MolecularWeight: 357.24284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)CCCCCN)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)CCCCCN)Br

InChI

InChI=1S/C15H21BrN2O3/c1-2-21-15(20)11-7-8-13(12(16)10-11)18-14(19)6-4-3-5-9-17/h7-8,10H,2-6,9,17H2,1H3,(H,18,19)