4-chloranyl-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[3-methoxy-4-[(2-methyl-1-oxopropyl)amino]phenyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[4-(isobutyrylamino)-3-methoxy-phenyl]-3-nitro-benzamide Formula: C18H18ClN3O5 MolecularWeight: 391.80562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18ClN3O5/c1-10(2)17(23)21-14-7-5-12(9-16(14)27-3)20-18(24)11-4-6-13(19)15(8-11)22(25)26/h4-10H,1-3H3,(H,20,24)(H,21,23)