N-[3-(dimethylamino)propyl]-2-[(4-iodanyl-2-methyl-phenyl)amino]-5-nitro-benzamide

Systemtic Name: N-[3-(dimethylamino)propyl]-2-[(4-iodanyl-2-methyl-phenyl)amino]-5-nitro-benzamide Openeye Name: N-[3-(dimethylamino)propyl]-2-(4-iodo-2-methyl-anilino)-5-nitro-benzamide CAS Name: N-[3-(dimethylamino)propyl]-2-(4-iodo-2-methylanilino)-5-nitrobenzamide IUPAC Name: N-[3-(dimethylamino)propyl]-2-(4-iodo-2-methylanilino)-5-nitrobenzamide Traditional Name: N-[3-(dimethylamino)propyl]-2-(4-iodo-2-methyl-anilino)-5-nitro-benzamide Formula: C19H23IN4O3 MolecularWeight: 482.31539

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCCCN(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCCCN(C)C

InChI

InChI=1S/C19H23IN4O3/c1-13-11-14(20)5-7-17(13)22-18-8-6-15(24(26)27)12-16(18)19(25)21-9-4-10-23(2)3/h5-8,11-12,22H,4,9-10H2,1-3H3,(H,21,25)