2-[[(2S)-8b-oxidanyl-3-(triphenylmethyl)-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-2-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[(2S)-8b-oxidanyl-3-(triphenylmethyl)-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-2-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[(2S)-8b-hydroxy-3-trityl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indole-2-carbonyl]amino]acetic acid CAS Name: 2-[[[(2S)-8b-hydroxy-3-(triphenylmethyl)-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-2-yl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[(2S)-8b-hydroxy-3-trityl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indole-2-carbonyl]amino]acetic acid Traditional Name: 2-[[(2S)-8b-hydroxy-3-trityl-1,2,3a,4-tetrahydropyrrol[2,3-b]indole-2-carbonyl]amino]acetic acid Formula: C32H29N3O4 MolecularWeight: 519.59036

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C2C1(C3=CC=CC=C3N2)O)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)C(=O)NCC(=O)O

Isomeric SMILES

C1[C@H](N(C2C1(C3=CC=CC=C3N2)O)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)C(=O)NCC(=O)O

InChI

InChI=1S/C32H29N3O4/c36-28(37)21-33-29(38)27-20-31(39)25-18-10-11-19-26(25)34-30(31)35(27)32(22-12-4-1-5-13-22,23-14-6-2-7-15-23)24-16-8-3-9-17-24/h1-19,27,30,34,39H,20-21H2,(H,33,38)(H,36,37)/t27-,30?,31?/m0/s1