[4-(3-bromanyl-4-methoxy-phenyl)sulfonylpiperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-(3-bromanyl-4-methoxy-phenyl)sulfonylpiperazin-1-yl]-phenyl-methanone Openeye Name: [4-(3-bromo-4-methoxy-phenyl)sulfonylpiperazin-1-yl]-phenyl-methanone CAS Name: [4-(3-bromo-4-methoxyphenyl)sulfonyl-1-piperazinyl]-phenylmethanone IUPAC Name: [4-(3-bromo-4-methoxyphenyl)sulfonylpiperazin-1-yl]-phenylmethanone Traditional Name: [4-(3-bromo-4-methoxy-phenyl)sulfonylpiperazino]-phenyl-methanone Formula: C18H19BrN2O4S MolecularWeight: 439.32346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3)Br

InChI

InChI=1S/C18H19BrN2O4S/c1-25-17-8-7-15(13-16(17)19)26(23,24)21-11-9-20(10-12-21)18(22)14-5-3-2-4-6-14/h2-8,13H,9-12H2,1H3