4-[5-phenylmethoxy-2-(2,4,6-trimethylphenyl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[5-phenylmethoxy-2-(2,4,6-trimethylphenyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[5-benzyloxy-2-(2,4,6-trimethylphenyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[5-phenylmethoxy-2-(2,4,6-trimethylphenyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[5-phenylmethoxy-2-(2,4,6-trimethylphenyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-(5-benzoxy-2-mesityl-1H-indol-3-yl)butylamine Formula: C28H32N2O MolecularWeight: 412.56648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C2=C(C3=C(N2)C=CC(=C3)OCC4=CC=CC=C4)CCCCN)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C2=C(C3=C(N2)C=CC(=C3)OCC4=CC=CC=C4)CCCCN)C

InChI

InChI=1S/C28H32N2O/c1-19-15-20(2)27(21(3)16-19)28-24(11-7-8-14-29)25-17-23(12-13-26(25)30-28)31-18-22-9-5-4-6-10-22/h4-6,9-10,12-13,15-17,30H,7-8,11,14,18,29H2,1-3H3