N-[1-(ethoxymethoxy)-5-[(methoxy-oxidanyl-thiophen-3-yl-methyl)amino]-5-oxidanylidene-pentan-2-yl]-4-nitro-benzamide

Systemtic Name: N-[1-(ethoxymethoxy)-5-[(methoxy-oxidanyl-thiophen-3-yl-methyl)amino]-5-oxidanylidene-pentan-2-yl]-4-nitro-benzamide Openeye Name: N-[1-(ethoxymethoxymethyl)-4-[[hydroxy-methoxy-(3-thienyl)methyl]amino]-4-oxo-butyl]-4-nitro-benzamide CAS Name: N-[1-(ethoxymethoxy)-5-[[hydroxy-methoxy-(3-thiophenyl)methyl]amino]-5-oxopentan-2-yl]-4-nitrobenzamide IUPAC Name: N-[1-(ethoxymethoxy)-5-[(hydroxy-methoxy-thiophen-3-ylmethyl)amino]-5-oxopentan-2-yl]-4-nitrobenzamide Traditional Name: N-[1-(ethoxymethoxymethyl)-4-[[hydroxy-methoxy-(3-thienyl)methyl]amino]-4-keto-butyl]-4-nitro-benzamide Formula: C21H27N3O8S MolecularWeight: 481.51938

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Descriptors Computed from Structure

Canonical SMILES:

CCOCOCC(CCC(=O)NC(C1=CSC=C1)(O)OC)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOCOCC(CCC(=O)NC(C1=CSC=C1)(O)OC)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H27N3O8S/c1-3-31-14-32-12-17(22-20(26)15-4-7-18(8-5-15)24(28)29)6-9-19(25)23-21(27,30-2)16-10-11-33-13-16/h4-5,7-8,10-11,13,17,27H,3,6,9,12,14H2,1-2H3,(H,22,26)(H,23,25)