1-[(1S)-1-[(3aR,5R,6S,6aR)-2,2-dimethyl-6-oxidanyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-oxidanyl-ethyl]-2,3-bis(phenylmethyl)guanidine hydrochloride

Systemtic Name: 1-[(1S)-1-[(3aR,5R,6S,6aR)-2,2-dimethyl-6-oxidanyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-oxidanyl-ethyl]-2,3-bis(phenylmethyl)guanidine hydrochloride Openeye Name: 1-[(1S)-1-[(3aR,5R,6S,6aR)-6-hydroxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-hydroxy-ethyl]-2,3-dibenzyl-guanidine hydrochloride CAS Name: 1-[(1S)-1-[(3aR,5R,6S,6aR)-6-hydroxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-hydroxyethyl]-2,3-bis(phenylmethyl)guanidine hydrochloride IUPAC Name: 1-[(1S)-1-[(3aR,5R,6S,6aR)-6-hydroxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-hydroxyethyl]-2,3-dibenzylguanidine hydrochloride Traditional Name: 1-[(1S)-1-[(3aR,5R,6S,6aR)-6-hydroxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-hydroxy-ethyl]-2,3-dibenzyl-guanidine hydrochloride Formula: C24H32ClN3O5 MolecularWeight: 477.98098

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2C(C(OC2O1)C(CO)NC(=NCC3=CC=CC=C3)NCC4=CC=CC=C4)O)C.Cl

Isomeric SMILES

CC1(O[C@@H]2[C@H]([C@H](O[C@@H]2O1)[C@H](CO)NC(=NCC3=CC=CC=C3)NCC4=CC=CC=C4)O)C.Cl

InChI

InChI=1S/C24H31N3O5.ClH/c1-24(2)31-21-19(29)20(30-22(21)32-24)18(15-28)27-23(25-13-16-9-5-3-6-10-16)26-14-17-11-7-4-8-12-17;/h3-12,18-22,28-29H,13-15H2,1-2H3,(H2,25,26,27);1H/t18-,19-,20+,21+,22+;/m0./s1