ethyl 2-ethanoyl-5-[(4-nitrophenyl)sulfonyl-phenyl-amino]pentanoate

Systemtic Name: ethyl 2-ethanoyl-5-[(4-nitrophenyl)sulfonyl-phenyl-amino]pentanoate Openeye Name: ethyl 2-acetyl-5-(N-(4-nitrophenyl)sulfonylanilino)pentanoate CAS Name: 2-acetyl-5-(N-(4-nitrophenyl)sulfonylanilino)pentanoic acid ethyl ester IUPAC Name: ethyl 2-acetyl-5-(N-(4-nitrophenyl)sulfonylanilino)pentanoate Traditional Name: 2-acetyl-5-(N-nosylanilino)valeric acid ethyl ester Formula: C21H24N2O7S MolecularWeight: 448.48946

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CCOC(=O)C(CCCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C21H24N2O7S/c1-3-30-21(25)20(16(2)24)10-7-15-22(17-8-5-4-6-9-17)31(28,29)19-13-11-18(12-14-19)23(26)27/h4-6,8-9,11-14,20H,3,7,10,15H2,1-2H3