5-ethoxy-4-methoxy-N-[2-(4-methylpiperidin-1-yl)-2-thiophen-2-yl-ethyl]-2-nitro-benzamide

Systemtic Name: 5-ethoxy-4-methoxy-N-[2-(4-methylpiperidin-1-yl)-2-thiophen-2-yl-ethyl]-2-nitro-benzamide Openeye Name: 5-ethoxy-4-methoxy-N-[2-(4-methyl-1-piperidyl)-2-(2-thienyl)ethyl]-2-nitro-benzamide CAS Name: 5-ethoxy-4-methoxy-N-[2-(4-methyl-1-piperidinyl)-2-thiophen-2-ylethyl]-2-nitrobenzamide IUPAC Name: 5-ethoxy-4-methoxy-N-[2-(4-methylpiperidin-1-yl)-2-thiophen-2-ylethyl]-2-nitrobenzamide Traditional Name: 5-ethoxy-4-methoxy-N-[2-(4-methylpiperidino)-2-(2-thienyl)ethyl]-2-nitro-benzamide Formula: C22H29N3O5S MolecularWeight: 447.54776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)NCC(C2=CC=CS2)N3CCC(CC3)C)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)NCC(C2=CC=CS2)N3CCC(CC3)C)[N+](=O)[O-])OC

InChI

InChI=1S/C22H29N3O5S/c1-4-30-20-12-16(17(25(27)28)13-19(20)29-3)22(26)23-14-18(21-6-5-11-31-21)24-9-7-15(2)8-10-24/h5-6,11-13,15,18H,4,7-10,14H2,1-3H3,(H,23,26)