N-[(2S)-2-(dimethylamino)-2-(4-fluorophenyl)ethyl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[(2S)-2-(dimethylamino)-2-(4-fluorophenyl)ethyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[(2S)-2-(dimethylamino)-2-(4-fluorophenyl)ethyl]-2-methyl-3-nitro-benzamide CAS Name: N-[(2S)-2-(dimethylamino)-2-(4-fluorophenyl)ethyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[(2S)-2-(dimethylamino)-2-(4-fluorophenyl)ethyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[(2S)-2-(dimethylamino)-2-(4-fluorophenyl)ethyl]-2-methyl-3-nitro-benzamide Formula: C18H20FN3O3 MolecularWeight: 345.368103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC(C2=CC=C(C=C2)F)N(C)C

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC[C@H](C2=CC=C(C=C2)F)N(C)C

InChI

InChI=1S/C18H20FN3O3/c1-12-15(5-4-6-16(12)22(24)25)18(23)20-11-17(21(2)3)13-7-9-14(19)10-8-13/h4-10,17H,11H2,1-3H3,(H,20,23)/t17-/m1/s1