4-[2-(5-bromanyl-2-methoxy-phenyl)-4,6-dimethyl-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-(5-bromanyl-2-methoxy-phenyl)-4,6-dimethyl-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(5-bromo-2-methoxy-phenyl)-4,6-dimethyl-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(5-bromo-2-methoxyphenyl)-4,6-dimethyl-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(5-bromo-2-methoxyphenyl)-4,6-dimethyl-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(5-bromo-2-methoxy-phenyl)-4,6-dimethyl-1H-indol-3-yl]butylamine Formula: C21H25BrN2O MolecularWeight: 401.34

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)NC(=C2CCCCN)C3=C(C=CC(=C3)Br)OC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)NC(=C2CCCCN)C3=C(C=CC(=C3)Br)OC)C

InChI

InChI=1S/C21H25BrN2O/c1-13-10-14(2)20-16(6-4-5-9-23)21(24-18(20)11-13)17-12-15(22)7-8-19(17)25-3/h7-8,10-12,24H,4-6,9,23H2,1-3H3