1H-indol-3-yl-[2-methyl-2-[4-(2-methylpropyl)phenyl]-1,3-benzodioxol-5-yl]methanone

Systemtic Name: 1H-indol-3-yl-[2-methyl-2-[4-(2-methylpropyl)phenyl]-1,3-benzodioxol-5-yl]methanone Openeye Name: 1H-indol-3-yl-[2-(4-isobutylphenyl)-2-methyl-1,3-benzodioxol-5-yl]methanone CAS Name: 1H-indol-3-yl-[2-methyl-2-[4-(2-methylpropyl)phenyl]-1,3-benzodioxol-5-yl]methanone IUPAC Name: 1H-indol-3-yl-[2-methyl-2-[4-(2-methylpropyl)phenyl]-1,3-benzodioxol-5-yl]methanone Traditional Name: 1H-indol-3-yl-[2-(4-isobutylphenyl)-2-methyl-1,3-benzodioxol-5-yl]methanone Formula: C27H25NO3 MolecularWeight: 411.4923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C2(OC3=C(O2)C=C(C=C3)C(=O)C4=CNC5=CC=CC=C54)C

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C2(OC3=C(O2)C=C(C=C3)C(=O)C4=CNC5=CC=CC=C54)C

InChI

InChI=1S/C27H25NO3/c1-17(2)14-18-8-11-20(12-9-18)27(3)30-24-13-10-19(15-25(24)31-27)26(29)22-16-28-23-7-5-4-6-21(22)23/h4-13,15-17,28H,14H2,1-3H3