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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O4/c1-3-23-17(20)14-9-10-15(16(11-14)19(21)22)18-12(2)13-7-5-4-6-8-13/h4-12,18H,3H2,1-2H3/t12-/m1/s1