(1R,2R,3S)-2-(4-dimethylaminophenyl)-3-methyl-1-(4-nitrophenyl)cyclopropane-1-carbonitrile

Systemtic Name: (1R,2R,3S)-2-(4-dimethylaminophenyl)-3-methyl-1-(4-nitrophenyl)cyclopropane-1-carbonitrile Openeye Name: (1R,2R,3S)-2-(4-dimethylaminophenyl)-3-methyl-1-(4-nitrophenyl)cyclopropanecarbonitrile CAS Name: (1R,2R,3S)-2-(4-dimethylaminophenyl)-3-methyl-1-(4-nitrophenyl)-1-cyclopropanecarbonitrile IUPAC Name: (1R,2R,3S)-2-(4-dimethylaminophenyl)-3-methyl-1-(4-nitrophenyl)cyclopropane-1-carbonitrile Traditional Name: (1R,2R,3S)-2-(4-dimethylaminophenyl)-3-methyl-1-(4-nitrophenyl)cyclopropanecarbonitrile Formula: C19H19N3O2 MolecularWeight: 321.37306

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C1(C#N)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)N(C)C

Isomeric SMILES

C[C@H]1[C@@H]([C@@]1(C#N)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C19H19N3O2/c1-13-18(14-4-8-16(9-5-14)21(2)3)19(13,12-20)15-6-10-17(11-7-15)22(23)24/h4-11,13,18H,1-3H3/t13-,18+,19+/m0/s1