2-diethylaminoethyl 4-[(3-nitrophenyl)carbonylamino]benzoate

Systemtic Name: 2-diethylaminoethyl 4-[(3-nitrophenyl)carbonylamino]benzoate Openeye Name: 2-diethylaminoethyl 4-[(3-nitrobenzoyl)amino]benzoate CAS Name: 4-[[(3-nitrophenyl)-oxomethyl]amino]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-[(3-nitrobenzoyl)amino]benzoate Traditional Name: 4-[(3-nitrobenzoyl)amino]benzoic acid 2-diethylaminoethyl ester Formula: C20H23N3O5 MolecularWeight: 385.41372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O5/c1-3-22(4-2)12-13-28-20(25)15-8-10-17(11-9-15)21-19(24)16-6-5-7-18(14-16)23(26)27/h5-11,14H,3-4,12-13H2,1-2H3,(H,21,24)