dimethyl 2-[2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]ethylamino]butanedioate dihydrochloride

Systemtic Name: dimethyl 2-[2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]ethylamino]butanedioate dihydrochloride Openeye Name: dimethyl 2-[2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]ethylamino]butanedioate dihydrochloride CAS Name: 2-[2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]ethylamino]butanedioic acid dimethyl ester dihydrochloride IUPAC Name: dimethyl 2-[2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]ethylamino]butanedioate dihydrochloride Traditional Name: 2-[2-[6-amidino-2-(4-amidinophenyl)-1H-indol-3-yl]ethylamino]succinic acid dimethyl ester dihydrochloride Formula: C24H30Cl2N6O4 MolecularWeight: 537.4388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C(=O)OC)NCCC1=C(NC2=C1C=CC(=C2)C(=N)N)C3=CC=C(C=C3)C(=N)N.Cl.Cl

Isomeric SMILES

COC(=O)CC(C(=O)OC)NCCC1=C(NC2=C1C=CC(=C2)C(=N)N)C3=CC=C(C=C3)C(=N)N.Cl.Cl

InChI

InChI=1S/C24H28N6O4.2ClH/c1-33-20(31)12-19(24(32)34-2)29-10-9-17-16-8-7-15(23(27)28)11-18(16)30-21(17)13-3-5-14(6-4-13)22(25)26;;/h3-8,11,19,29-30H,9-10,12H2,1-2H3,(H3,25,26)(H3,27,28);2*1H