methyl (7E)-10-bromanyl-1,2,3,4,5,6-hexahydro-1-benzazecine-7-carboxylate

Systemtic Name: methyl (7E)-10-bromanyl-1,2,3,4,5,6-hexahydro-1-benzazecine-7-carboxylate Openeye Name: methyl (7E)-10-bromo-1,2,3,4,5,6-hexahydro-1-benzazecine-7-carboxylate CAS Name: (7E)-10-bromo-1,2,3,4,5,6-hexahydro-1-benzazecine-7-carboxylic acid methyl ester IUPAC Name: methyl (7E)-10-bromo-1,2,3,4,5,6-hexahydro-1-benzazecine-7-carboxylate Traditional Name: (7E)-10-bromo-1,2,3,4,5,6-hexahydro-1-benzazecine-7-carboxylic acid methyl ester Formula: C15H18BrNO2 MolecularWeight: 324.21292

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=CC(=C2)Br)NCCCCC1

Isomeric SMILES

COC(=O)/C/1=C/C2=C(C=CC(=C2)Br)NCCCCC1

InChI

InChI=1S/C15H18BrNO2/c1-19-15(18)11-5-3-2-4-8-17-14-7-6-13(16)10-12(14)9-11/h6-7,9-10,17H,2-5,8H2,1H3/b11-9+