4-chloranyl-N-[3-methyl-1-(naphthalen-2-ylamino)-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[3-methyl-1-(naphthalen-2-ylamino)-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[2-methyl-1-(2-naphthylcarbamoyl)propyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[3-methyl-1-(2-naphthalenylamino)-1-oxobutan-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[3-methyl-1-(naphthalen-2-ylamino)-1-oxobutan-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[2-methyl-1-(2-naphthylcarbamoyl)propyl]-3-nitro-benzamide Formula: C22H20ClN3O4 MolecularWeight: 425.8649

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC2=CC=CC=C2C=C1)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(C(=O)NC1=CC2=CC=CC=C2C=C1)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H20ClN3O4/c1-13(2)20(25-21(27)16-8-10-18(23)19(12-16)26(29)30)22(28)24-17-9-7-14-5-3-4-6-15(14)11-17/h3-13,20H,1-2H3,(H,24,28)(H,25,27)