[(3S,3aR,6S,6aS)-3-[4-(3-indol-1-ylpropyl)piperazin-1-yl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate hydrochloride

Systemtic Name: [(3S,3aR,6S,6aS)-3-[4-(3-indol-1-ylpropyl)piperazin-1-yl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate hydrochloride Openeye Name: [(3S,3aR,6S,6aS)-3-[4-(3-indol-1-ylpropyl)piperazin-1-yl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate hydrochloride CAS Name: nitric acid [(3S,3aR,6S,6aS)-3-[4-[3-(1-indolyl)propyl]-1-piperazinyl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] ester hydrochloride IUPAC Name: [(3S,3aR,6S,6aS)-3-[4-(3-indol-1-ylpropyl)piperazin-1-yl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate hydrochloride Traditional Name: nitric acid [(3S,3aR,6S,6aS)-3-[4-(3-indol-1-ylpropyl)piperazino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] ester hydrochloride Formula: C21H29ClN4O5 MolecularWeight: 452.93176

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN2C=CC3=CC=CC=C32)C4COC5C4OCC5O[N+](=O)[O-].Cl

Isomeric SMILES

C1CN(CCN1CCCN2C=CC3=CC=CC=C32)[C@H]4CO[C@H]5[C@@H]4OC[C@@H]5O[N+](=O)[O-].Cl

InChI

InChI=1S/C21H28N4O5.ClH/c26-25(27)30-19-15-29-20-18(14-28-21(19)20)24-12-10-22(11-13-24)7-3-8-23-9-6-16-4-1-2-5-17(16)23;/h1-2,4-6,9,18-21H,3,7-8,10-15H2;1H/t18-,19-,20+,21+;/m0./s1