(4S)-4-methoxy-N-(2-methyl-4-nitro-phenyl)pyrrolidin-3-amine

Systemtic Name: (4S)-4-methoxy-N-(2-methyl-4-nitro-phenyl)pyrrolidin-3-amine Openeye Name: (4S)-4-methoxy-N-(2-methyl-4-nitro-phenyl)pyrrolidin-3-amine CAS Name: (4S)-4-methoxy-N-(2-methyl-4-nitrophenyl)-3-pyrrolidinamine IUPAC Name: (4S)-4-methoxy-N-(2-methyl-4-nitrophenyl)pyrrolidin-3-amine Traditional Name: [(4S)-4-methoxypyrrolidin-3-yl]-(2-methyl-4-nitro-phenyl)amine Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC2CNCC2OC

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC2CNC[C@@H]2OC

InChI

InChI=1S/C12H17N3O3/c1-8-5-9(15(16)17)3-4-10(8)14-11-6-13-7-12(11)18-2/h3-5,11-14H,6-7H2,1-2H3/t11?,12-/m0/s1