(7aS)-2-[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione

Systemtic Name: (7aS)-2-[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione Openeye Name: (7aS)-2-[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione CAS Name: (7aS)-2-[2-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]ethyl]-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione IUPAC Name: (7aS)-2-[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione Traditional Name: (7aS)-2-[2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]-5,6,7,7a-tetrahydropyrrol[1,2-c]imidazole-1,3-quinone Formula: C19H27N4O3+ MolecularWeight: 359.44268

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)CCN3C(=O)C4CCCN4C3=O

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)CCN3C(=O)[C@@H]4CCCN4C3=O

InChI

InChI=1S/C19H26N4O3/c1-26-17-7-3-2-5-15(17)21-12-9-20(10-13-21)11-14-23-18(24)16-6-4-8-22(16)19(23)25/h2-3,5,7,16H,4,6,8-14H2,1H3/p+1/t16-/m0/s1