(3R,4S)-4-(4-nitrophenyl)-1-(phenylmethyl)pyrrolidine-3-carbonitrile

Systemtic Name: (3R,4S)-4-(4-nitrophenyl)-1-(phenylmethyl)pyrrolidine-3-carbonitrile Openeye Name: (3R,4S)-1-benzyl-4-(4-nitrophenyl)pyrrolidine-3-carbonitrile CAS Name: (3R,4S)-4-(4-nitrophenyl)-1-(phenylmethyl)-3-pyrrolidinecarbonitrile IUPAC Name: (3R,4S)-1-benzyl-4-(4-nitrophenyl)pyrrolidine-3-carbonitrile Traditional Name: (3R,4S)-1-benzyl-4-(4-nitrophenyl)pyrrolidine-3-carbonitrile Formula: C18H17N3O2 MolecularWeight: 307.34648

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CN1CC2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1[C@@H]([C@H](CN1CC2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C18H17N3O2/c19-10-16-12-20(11-14-4-2-1-3-5-14)13-18(16)15-6-8-17(9-7-15)21(22)23/h1-9,16,18H,11-13H2/t16-,18+/m0/s1