2-[bis(2-hydroxyethyl)amino]-N-(4-methoxyphenyl)-5-nitro-benzamide

Systemtic Name: 2-[bis(2-hydroxyethyl)amino]-N-(4-methoxyphenyl)-5-nitro-benzamide Openeye Name: 2-[bis(2-hydroxyethyl)amino]-N-(4-methoxyphenyl)-5-nitro-benzamide CAS Name: 2-[bis(2-hydroxyethyl)amino]-N-(4-methoxyphenyl)-5-nitrobenzamide IUPAC Name: 2-[bis(2-hydroxyethyl)amino]-N-(4-methoxyphenyl)-5-nitrobenzamide Traditional Name: 2-[bis(2-hydroxyethyl)amino]-N-(4-methoxyphenyl)-5-nitro-benzamide Formula: C18H21N3O6 MolecularWeight: 375.37584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N(CCO)CCO

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N(CCO)CCO

InChI

InChI=1S/C18H21N3O6/c1-27-15-5-2-13(3-6-15)19-18(24)16-12-14(21(25)26)4-7-17(16)20(8-10-22)9-11-23/h2-7,12,22-23H,8-11H2,1H3,(H,19,24)