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

Systemtic Name: methyl (7E)-10-bromanyl-1-propyl-3,4,5,6-tetrahydro-2H-1-benzazecine-7-carboxylate Openeye Name: methyl (7E)-10-bromo-1-propyl-3,4,5,6-tetrahydro-2H-1-benzazecine-7-carboxylate CAS Name: (7E)-10-bromo-1-propyl-3,4,5,6-tetrahydro-2H-1-benzazecine-7-carboxylic acid methyl ester IUPAC Name: methyl (7E)-10-bromo-1-propyl-3,4,5,6-tetrahydro-2H-1-benzazecine-7-carboxylate Traditional Name: (7E)-10-bromo-1-propyl-3,4,5,6-tetrahydro-2H-1-benzazecine-7-carboxylic acid methyl ester Formula: C18H24BrNO2 MolecularWeight: 366.29266

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCCCCC(=CC2=C1C=CC(=C2)Br)C(=O)OC

Isomeric SMILES

CCCN1CCCCC/C(=C\C2=C1C=CC(=C2)Br)/C(=O)OC

InChI

InChI=1S/C18H24BrNO2/c1-3-10-20-11-6-4-5-7-14(18(21)22-2)12-15-13-16(19)8-9-17(15)20/h8-9,12-13H,3-7,10-11H2,1-2H3/b14-12+