oxan-2-ylmethyl 2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]ethanoate dihydrochloride

Systemtic Name: oxan-2-ylmethyl 2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]ethanoate dihydrochloride Openeye Name: tetrahydropyran-2-ylmethyl 2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]acetate dihydrochloride CAS Name: 2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]acetic acid 2-oxanylmethyl ester dihydrochloride IUPAC Name: oxan-2-ylmethyl 2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]acetate dihydrochloride Traditional Name: 2-[6-amidino-2-(4-amidinophenyl)-1H-indol-3-yl]acetic acid tetrahydropyran-2-ylmethyl ester dihydrochloride Formula: C24H29Cl2N5O3 MolecularWeight: 506.42476

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)COC(=O)CC2=C(NC3=C2C=CC(=C3)C(=N)N)C4=CC=C(C=C4)C(=N)N.Cl.Cl

Isomeric SMILES

C1CCOC(C1)COC(=O)CC2=C(NC3=C2C=CC(=C3)C(=N)N)C4=CC=C(C=C4)C(=N)N.Cl.Cl

InChI

InChI=1S/C24H27N5O3.2ClH/c25-23(26)15-6-4-14(5-7-15)22-19(12-21(30)32-13-17-3-1-2-10-31-17)18-9-8-16(24(27)28)11-20(18)29-22;;/h4-9,11,17,29H,1-3,10,12-13H2,(H3,25,26)(H3,27,28);2*1H