(1R,3R,3aR,6aS)-5-[(2S)-butan-2-yl]-7'-chloranyl-1-propan-2-yl-spiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrol-2-ium-3,3'-1H-indole]-2',4,6-trione

Systemtic Name: (1R,3R,3aR,6aS)-5-[(2S)-butan-2-yl]-7'-chloranyl-1-propan-2-yl-spiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrol-2-ium-3,3'-1H-indole]-2',4,6-trione Openeye Name: (1R,3R,3aR,6aS)-7'-chloro-1-isopropyl-5-[(1S)-1-methylpropyl]spiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrol-2-ium-3,3'-indoline]-2',4,6-trione CAS Name: (1R,3R,3aR,6aS)-5-[(2S)-butan-2-yl]-7'-chloro-1-propan-2-ylspiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrol-2-ium-3,3'-1H-indole]-2',4,6-trione IUPAC Name: (1R,3R,3aR,6aS)-5-[(2S)-butan-2-yl]-7'-chloro-1-propan-2-ylspiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrol-2-ium-3,3'-1H-indole]-2',4,6-trione Traditional Name: (1R,3R,3aR,6aS)-7'-chloro-1-isopropyl-5-[(1S)-1-methylpropyl]spiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrol-2-ium-3,3'-indoline]-2',4,6-trione Formula: C20H25ClN3O3+ MolecularWeight: 390.8838

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C2C(C1=O)C3(C4=C(C(=CC=C4)Cl)NC3=O)[NH2+]C2C(C)C

Isomeric SMILES

CC[C@H](C)N1C(=O)[C@H]2[C@@H](C1=O)[C@]3(C4=C(C(=CC=C4)Cl)NC3=O)[NH2+][C@@H]2C(C)C

InChI

InChI=1S/C20H24ClN3O3/c1-5-10(4)24-17(25)13-14(18(24)26)20(23-15(13)9(2)3)11-7-6-8-12(21)16(11)22-19(20)27/h6-10,13-15,23H,5H2,1-4H3,(H,22,27)/p+1/t10-,13-,14-,15+,20-/m0/s1