1-[(5-bromanyl-2-methoxy-phenyl)-naphthalen-2-yl-methyl]-1,4-diazepane

Systemtic Name: 1-[(5-bromanyl-2-methoxy-phenyl)-naphthalen-2-yl-methyl]-1,4-diazepane Openeye Name: 1-[(5-bromo-2-methoxy-phenyl)-(2-naphthyl)methyl]-1,4-diazepane CAS Name: 1-[(5-bromo-2-methoxyphenyl)-(2-naphthalenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-bromo-2-methoxyphenyl)-naphthalen-2-ylmethyl]-1,4-diazepane Traditional Name: 1-[(5-bromo-2-methoxy-phenyl)-(2-naphthyl)methyl]-1,4-diazepane Formula: C23H25BrN2O MolecularWeight: 425.3614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(C2=CC3=CC=CC=C3C=C2)N4CCCNCC4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(C2=CC3=CC=CC=C3C=C2)N4CCCNCC4

InChI

InChI=1S/C23H25BrN2O/c1-27-22-10-9-20(24)16-21(22)23(26-13-4-11-25-12-14-26)19-8-7-17-5-2-3-6-18(17)15-19/h2-3,5-10,15-16,23,25H,4,11-14H2,1H3