naphthalen-1-ylmethyl 4-morpholin-4-yl-3-nitro-benzoate

Systemtic Name: naphthalen-1-ylmethyl 4-morpholin-4-yl-3-nitro-benzoate Openeye Name: 1-naphthylmethyl 4-morpholino-3-nitro-benzoate CAS Name: 4-(4-morpholinyl)-3-nitrobenzoic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 4-morpholin-4-yl-3-nitrobenzoate Traditional Name: 4-morpholino-3-nitro-benzoic acid 1-naphthylmethyl ester Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)OCC3=CC=CC4=CC=CC=C43)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)OCC3=CC=CC4=CC=CC=C43)[N+](=O)[O-]

InChI

InChI=1S/C22H20N2O5/c25-22(29-15-18-6-3-5-16-4-1-2-7-19(16)18)17-8-9-20(21(14-17)24(26)27)23-10-12-28-13-11-23/h1-9,14H,10-13,15H2