4-chloranyl-N-[4-(dimethylamino)-3-[(phenylmethyl)carbamoyl]phenyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[4-(dimethylamino)-3-[(phenylmethyl)carbamoyl]phenyl]-3-nitro-benzamide Openeye Name: N-[3-(benzylcarbamoyl)-4-(dimethylamino)phenyl]-4-chloro-3-nitro-benzamide CAS Name: 4-chloro-N-[4-(dimethylamino)-3-[oxo-[(phenylmethyl)amino]methyl]phenyl]-3-nitrobenzamide IUPAC Name: N-[3-(benzylcarbamoyl)-4-(dimethylamino)phenyl]-4-chloro-3-nitrobenzamide Traditional Name: N-[3-(benzylcarbamoyl)-4-(dimethylamino)phenyl]-4-chloro-3-nitro-benzamide Formula: C23H21ClN4O4 MolecularWeight: 452.89024

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C23H21ClN4O4/c1-27(2)20-11-9-17(13-18(20)23(30)25-14-15-6-4-3-5-7-15)26-22(29)16-8-10-19(24)21(12-16)28(31)32/h3-13H,14H2,1-2H3,(H,25,30)(H,26,29)