tert-butyl 7-bromanyl-1-propyl-2,3-dihydro-1-benzazepine-4-carboxylate

Systemtic Name: tert-butyl 7-bromanyl-1-propyl-2,3-dihydro-1-benzazepine-4-carboxylate Openeye Name: tert-butyl 7-bromo-1-propyl-2,3-dihydro-1-benzazepine-4-carboxylate CAS Name: 7-bromo-1-propyl-2,3-dihydro-1-benzazepine-4-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 7-bromo-1-propyl-2,3-dihydro-1-benzazepine-4-carboxylate Traditional Name: 7-bromo-1-propyl-2,3-dihydro-1-benzazepine-4-carboxylic acid tert-butyl ester Formula: C18H24BrNO2 MolecularWeight: 366.29266

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(=CC2=C1C=CC(=C2)Br)C(=O)OC(C)(C)C

Isomeric SMILES

CCCN1CCC(=CC2=C1C=CC(=C2)Br)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H24BrNO2/c1-5-9-20-10-8-13(17(21)22-18(2,3)4)11-14-12-15(19)6-7-16(14)20/h6-7,11-12H,5,8-10H2,1-4H3