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

Systemtic Name: 1-[(5-bromanyl-2-ethoxy-phenyl)-naphthalen-1-yl-methyl]-1,4-diazepane Openeye Name: 1-[(5-bromo-2-ethoxy-phenyl)-(1-naphthyl)methyl]-1,4-diazepane CAS Name: 1-[(5-bromo-2-ethoxyphenyl)-(1-naphthalenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-bromo-2-ethoxyphenyl)-naphthalen-1-ylmethyl]-1,4-diazepane Traditional Name: 1-[(5-bromo-2-ethoxy-phenyl)-(1-naphthyl)methyl]-1,4-diazepane Formula: C24H27BrN2O MolecularWeight: 439.38798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C(C2=CC=CC3=CC=CC=C32)N4CCCNCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C(C2=CC=CC3=CC=CC=C32)N4CCCNCC4

InChI

InChI=1S/C24H27BrN2O/c1-2-28-23-12-11-19(25)17-22(23)24(27-15-6-13-26-14-16-27)21-10-5-8-18-7-3-4-9-20(18)21/h3-5,7-12,17,24,26H,2,6,13-16H2,1H3