N-[3-methyl-1-[(4-methyl-3-nitro-phenyl)amino]-1-oxidanylidene-pentan-2-yl]benzamide

Systemtic Name: N-[3-methyl-1-[(4-methyl-3-nitro-phenyl)amino]-1-oxidanylidene-pentan-2-yl]benzamide Openeye Name: N-[2-methyl-1-[(4-methyl-3-nitro-phenyl)carbamoyl]butyl]benzamide CAS Name: N-[3-methyl-1-(4-methyl-3-nitroanilino)-1-oxopentan-2-yl]benzamide IUPAC Name: N-[3-methyl-1-(4-methyl-3-nitroanilino)-1-oxopentan-2-yl]benzamide Traditional Name: N-[2-methyl-1-[(4-methyl-3-nitro-phenyl)carbamoyl]butyl]benzamide Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O4/c1-4-13(2)18(22-19(24)15-8-6-5-7-9-15)20(25)21-16-11-10-14(3)17(12-16)23(26)27/h5-13,18H,4H2,1-3H3,(H,21,25)(H,22,24)