[4-[(5-bromanyl-2-ethoxy-phenyl)methyl]piperazin-1-yl]-(1,4-dimethyl-3-phenyl-pyrrol-2-yl)methanone

Systemtic Name: [4-[(5-bromanyl-2-ethoxy-phenyl)methyl]piperazin-1-yl]-(1,4-dimethyl-3-phenyl-pyrrol-2-yl)methanone Openeye Name: [4-[(5-bromo-2-ethoxy-phenyl)methyl]piperazin-1-yl]-(1,4-dimethyl-3-phenyl-pyrrol-2-yl)methanone CAS Name: [4-[(5-bromo-2-ethoxyphenyl)methyl]-1-piperazinyl]-(1,4-dimethyl-3-phenyl-2-pyrrolyl)methanone IUPAC Name: [4-[(5-bromo-2-ethoxyphenyl)methyl]piperazin-1-yl]-(1,4-dimethyl-3-phenylpyrrol-2-yl)methanone Traditional Name: [4-(5-bromo-2-ethoxy-benzyl)piperazino]-(1,4-dimethyl-3-phenyl-pyrrol-2-yl)methanone Formula: C26H30BrN3O2 MolecularWeight: 496.4393

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)CN2CCN(CC2)C(=O)C3=C(C(=CN3C)C)C4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)CN2CCN(CC2)C(=O)C3=C(C(=CN3C)C)C4=CC=CC=C4

InChI

InChI=1S/C26H30BrN3O2/c1-4-32-23-11-10-22(27)16-21(23)18-29-12-14-30(15-13-29)26(31)25-24(19(2)17-28(25)3)20-8-6-5-7-9-20/h5-11,16-17H,4,12-15,18H2,1-3H3