4-morpholin-4-yl-N-(2-morpholin-4-yl-2-thiophen-2-yl-ethyl)-3-nitro-benzamide hydrochloride

Systemtic Name: 4-morpholin-4-yl-N-(2-morpholin-4-yl-2-thiophen-2-yl-ethyl)-3-nitro-benzamide hydrochloride Openeye Name: 4-morpholino-N-[2-morpholino-2-(2-thienyl)ethyl]-3-nitro-benzamide hydrochloride CAS Name: 4-(4-morpholinyl)-N-[2-(4-morpholinyl)-2-thiophen-2-ylethyl]-3-nitrobenzamide hydrochloride IUPAC Name: 4-morpholin-4-yl-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-3-nitrobenzamide hydrochloride Traditional Name: 4-morpholino-N-[2-morpholino-2-(2-thienyl)ethyl]-3-nitro-benzamide hydrochloride Formula: C21H27ClN4O5S MolecularWeight: 482.98088

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)NCC(C3=CC=CS3)N4CCOCC4)[N+](=O)[O-].Cl

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)NCC(C3=CC=CS3)N4CCOCC4)[N+](=O)[O-].Cl

InChI

InChI=1S/C21H26N4O5S.ClH/c26-21(22-15-19(20-2-1-13-31-20)24-7-11-30-12-8-24)16-3-4-17(18(14-16)25(27)28)23-5-9-29-10-6-23;/h1-4,13-14,19H,5-12,15H2,(H,22,26);1H