5-[4-(3-ethanoyl-4-nitro-phenoxy)butanoyl-(phenylmethyl)amino]pentyl ethanoate

Systemtic Name: 5-[4-(3-ethanoyl-4-nitro-phenoxy)butanoyl-(phenylmethyl)amino]pentyl ethanoate Openeye Name: 5-[4-(3-acetyl-4-nitro-phenoxy)butanoyl-benzyl-amino]pentyl acetate CAS Name: acetic acid 5-[[4-(3-acetyl-4-nitrophenoxy)-1-oxobutyl]-(phenylmethyl)amino]pentyl ester IUPAC Name: 5-[4-(3-acetyl-4-nitrophenoxy)butanoyl-benzylamino]pentyl acetate Traditional Name: acetic acid 5-[4-(3-acetyl-4-nitro-phenoxy)butanoyl-benzyl-amino]pentyl ester Formula: C26H32N2O7 MolecularWeight: 484.54148

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(=C1)OCCCC(=O)N(CCCCCOC(=O)C)CC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=C(C=CC(=C1)OCCCC(=O)N(CCCCCOC(=O)C)CC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C26H32N2O7/c1-20(29)24-18-23(13-14-25(24)28(32)33)35-17-9-12-26(31)27(19-22-10-5-3-6-11-22)15-7-4-8-16-34-21(2)30/h3,5-6,10-11,13-14,18H,4,7-9,12,15-17,19H2,1-2H3