[3-(dimethylamino)-1-phenyl-propyl] 4-chloranyl-2-nitro-benzoate

Systemtic Name: [3-(dimethylamino)-1-phenyl-propyl] 4-chloranyl-2-nitro-benzoate Openeye Name: [3-(dimethylamino)-1-phenyl-propyl] 4-chloro-2-nitro-benzoate CAS Name: 4-chloro-2-nitrobenzoic acid [3-(dimethylamino)-1-phenylpropyl] ester IUPAC Name: [3-(dimethylamino)-1-phenylpropyl] 4-chloro-2-nitrobenzoate Traditional Name: 4-chloro-2-nitro-benzoic acid [3-(dimethylamino)-1-phenyl-propyl] ester Formula: C18H19ClN2O4 MolecularWeight: 362.80746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19ClN2O4/c1-20(2)11-10-17(13-6-4-3-5-7-13)25-18(22)15-9-8-14(19)12-16(15)21(23)24/h3-9,12,17H,10-11H2,1-2H3