7-bromanyl-1-(3-methylbutyl)-2,3-dihydro-1-benzazepine-4-carboxylic acid

Systemtic Name: 7-bromanyl-1-(3-methylbutyl)-2,3-dihydro-1-benzazepine-4-carboxylic acid Openeye Name: 7-bromo-1-isopentyl-2,3-dihydro-1-benzazepine-4-carboxylic acid CAS Name: 7-bromo-1-(3-methylbutyl)-2,3-dihydro-1-benzazepine-4-carboxylic acid IUPAC Name: 7-bromo-1-(3-methylbutyl)-2,3-dihydro-1-benzazepine-4-carboxylic acid Traditional Name: 7-bromo-1-isoamyl-2,3-dihydro-1-benzazepine-4-carboxylic acid Formula: C16H20BrNO2 MolecularWeight: 338.2395

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1CCC(=CC2=C1C=CC(=C2)Br)C(=O)O

Isomeric SMILES

CC(C)CCN1CCC(=CC2=C1C=CC(=C2)Br)C(=O)O

InChI

InChI=1S/C16H20BrNO2/c1-11(2)5-7-18-8-6-12(16(19)20)9-13-10-14(17)3-4-15(13)18/h3-4,9-11H,5-8H2,1-2H3,(H,19,20)