[(1R)-1-phenylethyl] 4-(dimethylamino)-3-nitro-benzoate

Systemtic Name: [(1R)-1-phenylethyl] 4-(dimethylamino)-3-nitro-benzoate Openeye Name: [(1R)-1-phenylethyl] 4-(dimethylamino)-3-nitro-benzoate CAS Name: 4-(dimethylamino)-3-nitrobenzoic acid [(1R)-1-phenylethyl] ester IUPAC Name: [(1R)-1-phenylethyl] 4-(dimethylamino)-3-nitrobenzoate Traditional Name: 4-(dimethylamino)-3-nitro-benzoic acid [(1R)-1-phenylethyl] ester Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC(=O)C2=CC(=C(C=C2)N(C)C)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=CC=CC=C1)OC(=O)C2=CC(=C(C=C2)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O4/c1-12(13-7-5-4-6-8-13)23-17(20)14-9-10-15(18(2)3)16(11-14)19(21)22/h4-12H,1-3H3/t12-/m1/s1