2-[4-(6-chloranyl-3-methanoyl-2-nitro-phenoxy)butanoyl-(1-cyclopentylbutyl)amino]ethyl ethanoate

Systemtic Name: 2-[4-(6-chloranyl-3-methanoyl-2-nitro-phenoxy)butanoyl-(1-cyclopentylbutyl)amino]ethyl ethanoate Openeye Name: 2-[4-(6-chloro-3-formyl-2-nitro-phenoxy)butanoyl-(1-cyclopentylbutyl)amino]ethyl acetate CAS Name: acetic acid 2-[[4-(6-chloro-3-formyl-2-nitrophenoxy)-1-oxobutyl]-(1-cyclopentylbutyl)amino]ethyl ester IUPAC Name: 2-[4-(6-chloro-3-formyl-2-nitrophenoxy)butanoyl-(1-cyclopentylbutyl)amino]ethyl acetate Traditional Name: acetic acid 2-[4-(6-chloro-3-formyl-2-nitro-phenoxy)butanoyl-(1-cyclopentylbutyl)amino]ethyl ester Formula: C24H33ClN2O7 MolecularWeight: 496.98102

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1CCCC1)N(CCOC(=O)C)C(=O)CCCOC2=C(C=CC(=C2[N+](=O)[O-])C=O)Cl

Isomeric SMILES

CCCC(C1CCCC1)N(CCOC(=O)C)C(=O)CCCOC2=C(C=CC(=C2[N+](=O)[O-])C=O)Cl

InChI

InChI=1S/C24H33ClN2O7/c1-3-7-21(18-8-4-5-9-18)26(13-15-33-17(2)29)22(30)10-6-14-34-24-20(25)12-11-19(16-28)23(24)27(31)32/h11-12,16,18,21H,3-10,13-15H2,1-2H3