(6-bromanyl-3-ethoxycarbonyl-5-methoxy-1-phenyl-indol-2-yl)methyl-cyclohexyl-azanium

Systemtic Name: (6-bromanyl-3-ethoxycarbonyl-5-methoxy-1-phenyl-indol-2-yl)methyl-cyclohexyl-azanium Openeye Name: (6-bromo-3-ethoxycarbonyl-5-methoxy-1-phenyl-indol-2-yl)methyl-cyclohexyl-ammonium CAS Name: (6-bromo-3-ethoxycarbonyl-5-methoxy-1-phenyl-2-indolyl)methyl-cyclohexylammonium IUPAC Name: (6-bromo-3-ethoxycarbonyl-5-methoxy-1-phenylindol-2-yl)methyl-cyclohexylazanium Traditional Name: (6-bromo-3-carbethoxy-5-methoxy-1-phenyl-indol-2-yl)methyl-cyclohexyl-ammonium Formula: C25H30BrN2O3+ MolecularWeight: 486.4213

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C3=CC=CC=C3)C[NH2+]C4CCCCC4

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C3=CC=CC=C3)C[NH2+]C4CCCCC4

InChI

InChI=1S/C25H29BrN2O3/c1-3-31-25(29)24-19-14-23(30-2)20(26)15-21(19)28(18-12-8-5-9-13-18)22(24)16-27-17-10-6-4-7-11-17/h5,8-9,12-15,17,27H,3-4,6-7,10-11,16H2,1-2H3/p+1