(2S,4S)-4-(diphenylmethyl)pyrrolidin-1-ium-2-carboxylate

Systemtic Name: (2S,4S)-4-(diphenylmethyl)pyrrolidin-1-ium-2-carboxylate Openeye Name: (2S,4S)-4-benzhydrylpyrrolidin-1-ium-2-carboxylate CAS Name: (2S,4S)-4-(diphenylmethyl)-2-pyrrolidin-1-iumcarboxylate IUPAC Name: (2S,4S)-4-benzhydrylpyrrolidin-1-ium-2-carboxylate Traditional Name: (2S,4S)-4-benzhydrylpyrrolidin-1-ium-2-carboxylate Formula: C18H19NO2 MolecularWeight: 281.34896

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C[NH2+]C1C(=O)[O-])C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1[C@H](C[NH2+][C@@H]1C(=O)[O-])C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H19NO2/c20-18(21)16-11-15(12-19-16)17(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15-17,19H,11-12H2,(H,20,21)/t15-,16+/m1/s1