N-[[4-(5-azanyl-5-oxidanylidene-pentoxy)-2-oxidanyl-phenyl]methyl]-N-(4-methoxyphenyl)-4-nitro-benzamide

Systemtic Name: N-[[4-(5-azanyl-5-oxidanylidene-pentoxy)-2-oxidanyl-phenyl]methyl]-N-(4-methoxyphenyl)-4-nitro-benzamide Openeye Name: N-[[4-(5-amino-5-oxo-pentoxy)-2-hydroxy-phenyl]methyl]-N-(4-methoxyphenyl)-4-nitro-benzamide CAS Name: N-[[4-(5-amino-5-oxopentoxy)-2-hydroxyphenyl]methyl]-N-(4-methoxyphenyl)-4-nitrobenzamide IUPAC Name: N-[[4-(5-amino-5-oxopentoxy)-2-hydroxyphenyl]methyl]-N-(4-methoxyphenyl)-4-nitrobenzamide Traditional Name: N-[4-(5-amino-5-keto-pentoxy)-2-hydroxy-benzyl]-N-(4-methoxyphenyl)-4-nitro-benzamide Formula: C26H27N3O7 MolecularWeight: 493.50848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC2=C(C=C(C=C2)OCCCCC(=O)N)O)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N(CC2=C(C=C(C=C2)OCCCCC(=O)N)O)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C26H27N3O7/c1-35-22-13-10-20(11-14-22)28(26(32)18-5-8-21(9-6-18)29(33)34)17-19-7-12-23(16-24(19)30)36-15-3-2-4-25(27)31/h5-14,16,30H,2-4,15,17H2,1H3,(H2,27,31)