[5-(morpholin-4-ylmethyl)quinolin-8-yl] 4-nitrobenzoate

Systemtic Name: [5-(morpholin-4-ylmethyl)quinolin-8-yl] 4-nitrobenzoate Openeye Name: [5-(morpholinomethyl)-8-quinolyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [5-(4-morpholinylmethyl)-8-quinolinyl] ester IUPAC Name: [5-(morpholin-4-ylmethyl)quinolin-8-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [5-(morpholinomethyl)-8-quinolyl] ester Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=C3C=CC=NC3=C(C=C2)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CC2=C3C=CC=NC3=C(C=C2)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O5/c25-21(15-3-6-17(7-4-15)24(26)27)29-19-8-5-16(14-23-10-12-28-13-11-23)18-2-1-9-22-20(18)19/h1-9H,10-14H2