4-[2-(2,4-dimethylphenyl)-5-phenoxy-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-(2,4-dimethylphenyl)-5-phenoxy-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(2,4-dimethylphenyl)-5-phenoxy-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(2,4-dimethylphenyl)-5-phenoxy-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(2,4-dimethylphenyl)-5-phenoxy-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(2,4-dimethylphenyl)-5-phenoxy-1H-indol-3-yl]butylamine Formula: C26H28N2O MolecularWeight: 384.51332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)OC4=CC=CC=C4)CCCCN)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)OC4=CC=CC=C4)CCCCN)C

InChI

InChI=1S/C26H28N2O/c1-18-11-13-22(19(2)16-18)26-23(10-6-7-15-27)24-17-21(12-14-25(24)28-26)29-20-8-4-3-5-9-20/h3-5,8-9,11-14,16-17,28H,6-7,10,15,27H2,1-2H3