[4-(4-carbamimidoylphenyl)-2-(cyclohexylmethyl)-1,3-bis(oxidanylidene)-3a,4,6,7,8,8b-hexahydropyrrolo[3,4-a]pyrrolizin-8a-yl] hydrogen carbonate

Systemtic Name: [4-(4-carbamimidoylphenyl)-2-(cyclohexylmethyl)-1,3-bis(oxidanylidene)-3a,4,6,7,8,8b-hexahydropyrrolo[3,4-a]pyrrolizin-8a-yl] hydrogen carbonate Openeye Name: [4-(4-carbamimidoylphenyl)-2-(cyclohexylmethyl)-1,3-dioxo-3a,4,6,7,8,8b-hexahydropyrrolo[3,4-a]pyrrolizin-8a-yl] hydrogen carbonate CAS Name: carbonic acid [4-(4-carbamimidoylphenyl)-2-(cyclohexylmethyl)-1,3-dioxo-3a,4,6,7,8,8b-hexahydropyrrolo[3,4-a]pyrrolizin-8a-yl] ester IUPAC Name: [4-(4-carbamimidoylphenyl)-2-(cyclohexylmethyl)-1,3-dioxo-3a,4,6,7,8,8b-hexahydropyrrolo[3,4-a]pyrrolizin-8a-yl] hydrogen carbonate Traditional Name: carbonic acid [4-(4-amidinophenyl)-2-(cyclohexylmethyl)-1,3-diketo-3a,4,6,7,8,8b-hexahydropyrrolo[3,4-a]pyrrolizin-8a-yl] ester Formula: C24H30N4O5 MolecularWeight: 454.5188

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C(=O)C3C(C2=O)C4(CCCN4C3C5=CC=C(C=C5)C(=N)N)OC(=O)O

Isomeric SMILES

C1CCC(CC1)CN2C(=O)C3C(C2=O)C4(CCCN4C3C5=CC=C(C=C5)C(=N)N)OC(=O)O

InChI

InChI=1S/C24H30N4O5/c25-20(26)16-9-7-15(8-10-16)19-17-18(24(33-23(31)32)11-4-12-28(19)24)22(30)27(21(17)29)13-14-5-2-1-3-6-14/h7-10,14,17-19H,1-6,11-13H2,(H3,25,26)(H,31,32)