N-[(3-chloranyl-4-methoxy-phenyl)methyl]-5-nitro-2-oxidanyl-3-(1-oxidanylpropan-2-ylamino)benzamide

Systemtic Name: N-[(3-chloranyl-4-methoxy-phenyl)methyl]-5-nitro-2-oxidanyl-3-(1-oxidanylpropan-2-ylamino)benzamide Openeye Name: N-[(3-chloro-4-methoxy-phenyl)methyl]-2-hydroxy-3-[(2-hydroxy-1-methyl-ethyl)amino]-5-nitro-benzamide CAS Name: N-[(3-chloro-4-methoxyphenyl)methyl]-2-hydroxy-3-(1-hydroxypropan-2-ylamino)-5-nitrobenzamide IUPAC Name: N-[(3-chloro-4-methoxyphenyl)methyl]-2-hydroxy-3-(1-hydroxypropan-2-ylamino)-5-nitrobenzamide Traditional Name: N-(3-chloro-4-methoxy-benzyl)-2-hydroxy-3-[(2-hydroxy-1-methyl-ethyl)amino]-5-nitro-benzamide Formula: C18H20ClN3O6 MolecularWeight: 409.8209

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)NC1=C(C(=CC(=C1)[N+](=O)[O-])C(=O)NCC2=CC(=C(C=C2)OC)Cl)O

Isomeric SMILES

CC(CO)NC1=C(C(=CC(=C1)[N+](=O)[O-])C(=O)NCC2=CC(=C(C=C2)OC)Cl)O

InChI

InChI=1S/C18H20ClN3O6/c1-10(9-23)21-15-7-12(22(26)27)6-13(17(15)24)18(25)20-8-11-3-4-16(28-2)14(19)5-11/h3-7,10,21,23-24H,8-9H2,1-2H3,(H,20,25)