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methyl 7-bromanyl-1-(3-methylbutyl)-2,3-dihydro-1-benzazepine-4-carboxylate

methyl 7-bromanyl-1-(3-methylbutyl)-2,3-dihydro-1-benzazepine-4-carboxylate

Systemtic Name:methyl 7-bromanyl-1-(3-methylbutyl)-2,3-dihydro-1-benzazepine-4-carboxylate
Openeye Name:methyl 7-bromo-1-isopentyl-2,3-dihydro-1-benzazepine-4-carboxylate
CAS Name:7-bromo-1-(3-methylbutyl)-2,3-dihydro-1-benzazepine-4-carboxylic acid methyl ester
IUPAC Name:methyl 7-bromo-1-(3-methylbutyl)-2,3-dihydro-1-benzazepine-4-carboxylate
Traditional Name:7-bromo-1-isoamyl-2,3-dihydro-1-benzazepine-4-carboxylic acid methyl ester
Formula: C17H22BrNO2
MolecularWeight: 352.26608
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C17H22BrNO2/c1-12(2)6-8-19-9-7-13(17(20)21-3)10-14-11-15(18)4-5-16(14)19/h4-5,10-12H,6-9H2,1-3H3


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