2-chloranyl-N1,N4-bis[4-(N,N'-dimethylcarbamimidoyl)-3-methoxy-phenyl]benzene-1,4-dicarboxamide

Systemtic Name: 2-chloranyl-N1,N4-bis[4-(N,N'-dimethylcarbamimidoyl)-3-methoxy-phenyl]benzene-1,4-dicarboxamide Openeye Name: 2-chloro-N1,N4-bis[4-(N,N'-dimethylcarbamimidoyl)-3-methoxy-phenyl]terephthalamide CAS Name: 2-chloro-N1,N4-bis[3-methoxy-4-[methylamino(methylimino)methyl]phenyl]benzene-1,4-dicarboxamide IUPAC Name: 2-chloro-1-N,4-N-bis[4-(N,N'-dimethylcarbamimidoyl)-3-methoxyphenyl]benzene-1,4-dicarboxamide Traditional Name: 2-chloro-N,N'-bis[4-(N,N'-dimethylamidino)-3-methoxy-phenyl]terephthalamide Formula: C28H31ClN6O4 MolecularWeight: 551.03654

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=NC)C1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)C(=O)NC3=CC(=C(C=C3)C(=NC)NC)OC)Cl)OC

Isomeric SMILES

CNC(=NC)C1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)C(=O)NC3=CC(=C(C=C3)C(=NC)NC)OC)Cl)OC

InChI

InChI=1S/C28H31ClN6O4/c1-30-25(31-2)20-11-8-17(14-23(20)38-5)34-27(36)16-7-10-19(22(29)13-16)28(37)35-18-9-12-21(24(15-18)39-6)26(32-3)33-4/h7-15H,1-6H3,(H,30,31)(H,32,33)(H,34,36)(H,35,37)