[1-(9H-carbazol-4-yloxy)-3-[2-(2-methoxyphenoxy)ethylamino]propan-2-yl] 4-nitrooxybutanoate

Systemtic Name: [1-(9H-carbazol-4-yloxy)-3-[2-(2-methoxyphenoxy)ethylamino]propan-2-yl] 4-nitrooxybutanoate Openeye Name: [1-(9H-carbazol-4-yloxymethyl)-2-[2-(2-methoxyphenoxy)ethylamino]ethyl] 4-nitrooxybutanoate CAS Name: 4-nitrooxybutanoic acid [1-(9H-carbazol-4-yloxy)-3-[2-(2-methoxyphenoxy)ethylamino]propan-2-yl] ester IUPAC Name: [1-(9H-carbazol-4-yloxy)-3-[2-(2-methoxyphenoxy)ethylamino]propan-2-yl] 4-nitrooxybutanoate Traditional Name: 4-nitrooxybutyric acid [1-(9H-carbazol-4-yloxymethyl)-2-[2-(2-methoxyphenoxy)ethylamino]ethyl] ester Formula: C28H31N3O8 MolecularWeight: 537.56104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCCNCC(COC2=CC=CC3=C2C4=CC=CC=C4N3)OC(=O)CCCO[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1OCCNCC(COC2=CC=CC3=C2C4=CC=CC=C4N3)OC(=O)CCCO[N+](=O)[O-]

InChI

InChI=1S/C28H31N3O8/c1-35-24-11-4-5-12-25(24)36-17-15-29-18-20(39-27(32)14-7-16-38-31(33)34)19-37-26-13-6-10-23-28(26)21-8-2-3-9-22(21)30-23/h2-6,8-13,20,29-30H,7,14-19H2,1H3