8-chloranyl-7-[[(2R,3R)-6-chloranyl-2-(imidazol-1-ylmethyl)-2,3-dihydro-1-benzothiophen-3-yl]oxymethyl]-[1,3]dioxolo[4,5-g]quinoline

Systemtic Name: 8-chloranyl-7-[[(2R,3R)-6-chloranyl-2-(imidazol-1-ylmethyl)-2,3-dihydro-1-benzothiophen-3-yl]oxymethyl]-[1,3]dioxolo[4,5-g]quinoline Openeye Name: 8-chloro-7-[[(2R,3R)-6-chloro-2-(imidazol-1-ylmethyl)-2,3-dihydrobenzothiophen-3-yl]oxymethyl]-[1,3]dioxolo[4,5-g]quinoline CAS Name: 8-chloro-7-[[(2R,3R)-6-chloro-2-(1-imidazolylmethyl)-2,3-dihydro-1-benzothiophen-3-yl]oxymethyl]-[1,3]dioxolo[4,5-g]quinoline IUPAC Name: 8-chloro-7-[[(2R,3R)-6-chloro-2-(imidazol-1-ylmethyl)-2,3-dihydro-1-benzothiophen-3-yl]oxymethyl]-[1,3]dioxolo[4,5-g]quinoline Traditional Name: 8-chloro-7-[[(2R,3R)-6-chloro-2-(imidazol-1-ylmethyl)-2,3-dihydrobenzothiophen-3-yl]oxymethyl]-[1,3]dioxolo[4,5-g]quinoline Formula: C23H17Cl2N3O3S MolecularWeight: 486.37038

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C3C(=C2)C(=C(C=N3)COC4C(SC5=C4C=CC(=C5)Cl)CN6C=CN=C6)Cl

Isomeric SMILES

C1OC2=C(O1)C=C3C(=C2)C(=C(C=N3)CO[C@H]4[C@H](SC5=C4C=CC(=C5)Cl)CN6C=CN=C6)Cl

InChI

InChI=1S/C23H17Cl2N3O3S/c24-14-1-2-15-20(5-14)32-21(9-28-4-3-26-11-28)23(15)29-10-13-8-27-17-7-19-18(30-12-31-19)6-16(17)22(13)25/h1-8,11,21,23H,9-10,12H2/t21-,23-/m1/s1