prop-2-ynyl 2-[(2-chloranyl-4-nitro-phenyl)carbamoyl]benzoate

Systemtic Name: prop-2-ynyl 2-[(2-chloranyl-4-nitro-phenyl)carbamoyl]benzoate Openeye Name: prop-2-ynyl 2-[(2-chloro-4-nitro-phenyl)carbamoyl]benzoate CAS Name: 2-[(2-chloro-4-nitroanilino)-oxomethyl]benzoic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 2-[(2-chloro-4-nitrophenyl)carbamoyl]benzoate Traditional Name: 2-[(2-chloro-4-nitro-phenyl)carbamoyl]benzoic acid propargyl ester Formula: C17H11ClN2O5 MolecularWeight: 358.73264

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)C1=CC=CC=C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C#CCOC(=O)C1=CC=CC=C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H11ClN2O5/c1-2-9-25-17(22)13-6-4-3-5-12(13)16(21)19-15-8-7-11(20(23)24)10-14(15)18/h1,3-8,10H,9H2,(H,19,21)