2-[(1R,3S)-2,2-dimethyl-3-[2-methyl-1-(phenylmethyl)indol-3-yl]cyclopropyl]ethanenitrile

Systemtic Name: 2-[(1R,3S)-2,2-dimethyl-3-[2-methyl-1-(phenylmethyl)indol-3-yl]cyclopropyl]ethanenitrile Openeye Name: 2-[(1R,3S)-3-(1-benzyl-2-methyl-indol-3-yl)-2,2-dimethyl-cyclopropyl]acetonitrile CAS Name: 2-[(1R,3S)-2,2-dimethyl-3-[2-methyl-1-(phenylmethyl)-3-indolyl]cyclopropyl]acetonitrile IUPAC Name: 2-[(1R,3S)-3-(1-benzyl-2-methylindol-3-yl)-2,2-dimethylcyclopropyl]acetonitrile Traditional Name: 2-[(1R,3S)-3-(1-benzyl-2-methyl-indol-3-yl)-2,2-dimethyl-cyclopropyl]acetonitrile Formula: C23H24N2 MolecularWeight: 328.45006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3)C4C(C4(C)C)CC#N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3)[C@H]4[C@H](C4(C)C)CC#N

InChI

InChI=1S/C23H24N2/c1-16-21(22-19(13-14-24)23(22,2)3)18-11-7-8-12-20(18)25(16)15-17-9-5-4-6-10-17/h4-12,19,22H,13,15H2,1-3H3/t19-,22-/m1/s1