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

Systemtic Name: N-[[4-(5-azanyl-5-oxidanylidene-pentoxy)-2-methoxy-phenyl]methyl]-N-(4-methoxyphenyl)-4-nitro-benzamide Openeye Name: N-[[4-(5-amino-5-oxo-pentoxy)-2-methoxy-phenyl]methyl]-N-(4-methoxyphenyl)-4-nitro-benzamide CAS Name: N-[[4-(5-amino-5-oxopentoxy)-2-methoxyphenyl]methyl]-N-(4-methoxyphenyl)-4-nitrobenzamide IUPAC Name: N-[[4-(5-amino-5-oxopentoxy)-2-methoxyphenyl]methyl]-N-(4-methoxyphenyl)-4-nitrobenzamide Traditional Name: N-[4-(5-amino-5-keto-pentoxy)-2-methoxy-benzyl]-N-(4-methoxyphenyl)-4-nitro-benzamide Formula: C27H29N3O7 MolecularWeight: 507.53506

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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)OC)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)OC)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C27H29N3O7/c1-35-23-14-11-21(12-15-23)29(27(32)19-6-9-22(10-7-19)30(33)34)18-20-8-13-24(17-25(20)36-2)37-16-4-3-5-26(28)31/h6-15,17H,3-5,16,18H2,1-2H3,(H2,28,31)