1-[3-[4-(4-methylpentyl)phenyl]morpholin-4-yl]ethyl nitrate

Systemtic Name: 1-[3-[4-(4-methylpentyl)phenyl]morpholin-4-yl]ethyl nitrate Openeye Name: 1-[3-(4-isohexylphenyl)morpholin-4-yl]ethyl nitrate CAS Name: nitric acid 1-[3-[4-(4-methylpentyl)phenyl]-4-morpholinyl]ethyl ester IUPAC Name: 1-[3-[4-(4-methylpentyl)phenyl]morpholin-4-yl]ethyl nitrate Traditional Name: nitric acid 1-[3-(4-isohexylphenyl)morpholino]ethyl ester Formula: C18H28N2O4 MolecularWeight: 336.42592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC1=CC=C(C=C1)C2COCCN2C(C)O[N+](=O)[O-]

Isomeric SMILES

CC(C)CCCC1=CC=C(C=C1)C2COCCN2C(C)O[N+](=O)[O-]

InChI

InChI=1S/C18H28N2O4/c1-14(2)5-4-6-16-7-9-17(10-8-16)18-13-23-12-11-19(18)15(3)24-20(21)22/h7-10,14-15,18H,4-6,11-13H2,1-3H3