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(3,4-dimethylphenyl) 4-(2-methoxyethylamino)-3-nitro-benzoate

(3,4-dimethylphenyl) 4-(2-methoxyethylamino)-3-nitro-benzoate

Systemtic Name:(3,4-dimethylphenyl) 4-(2-methoxyethylamino)-3-nitro-benzoate
Openeye Name:(3,4-dimethylphenyl) 4-(2-methoxyethylamino)-3-nitro-benzoate
CAS Name:4-(2-methoxyethylamino)-3-nitrobenzoic acid (3,4-dimethylphenyl) ester
IUPAC Name:(3,4-dimethylphenyl) 4-(2-methoxyethylamino)-3-nitrobenzoate
Traditional Name:4-(2-methoxyethylamino)-3-nitro-benzoic acid (3,4-dimethylphenyl) ester
Formula: C18H20N2O5
MolecularWeight: 344.3618
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(=O)C2=CC(=C(C=C2)NCCOC)[N+](=O)[O-])C


Isomeric SMILES

CC1=C(C=C(C=C1)OC(=O)C2=CC(=C(C=C2)NCCOC)[N+](=O)[O-])C


InChI

InChI=1S/C18H20N2O5/c1-12-4-6-15(10-13(12)2)25-18(21)14-5-7-16(19-8-9-24-3)17(11-14)20(22)23/h4-7,10-11,19H,8-9H2,1-3H3


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