2-diethylaminoethyl 4-[(2-nitrophenyl)carbamoylamino]benzoate chloride

Systemtic Name: 2-diethylaminoethyl 4-[(2-nitrophenyl)carbamoylamino]benzoate chloride Openeye Name: 2-diethylaminoethyl 4-[(2-nitrophenyl)carbamoylamino]benzoate chloride CAS Name: 4-[[(2-nitroanilino)-oxomethyl]amino]benzoic acid 2-diethylaminoethyl ester chloride IUPAC Name: 2-diethylaminoethyl 4-[(2-nitrophenyl)carbamoylamino]benzoate chloride Traditional Name: 4-[(2-nitrophenyl)carbamoylamino]benzoic acid 2-diethylaminoethyl ester chloride Formula: C20H24ClN4O5- MolecularWeight: 435.88136

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2[N+](=O)[O-].[Cl-]

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C20H24N4O5.ClH/c1-3-23(4-2)13-14-29-19(25)15-9-11-16(12-10-15)21-20(26)22-17-7-5-6-8-18(17)24(27)28;/h5-12H,3-4,13-14H2,1-2H3,(H2,21,22,26);1H/p-1