[2-(morpholin-4-ylmethyl)phenyl]methyl 2-chloranyl-4-nitro-benzoate hydrochloride

Systemtic Name: [2-(morpholin-4-ylmethyl)phenyl]methyl 2-chloranyl-4-nitro-benzoate hydrochloride Openeye Name: [2-(morpholinomethyl)phenyl]methyl 2-chloro-4-nitro-benzoate hydrochloride CAS Name: 2-chloro-4-nitrobenzoic acid [2-(4-morpholinylmethyl)phenyl]methyl ester hydrochloride IUPAC Name: [2-(morpholin-4-ylmethyl)phenyl]methyl 2-chloro-4-nitrobenzoate hydrochloride Traditional Name: 2-chloro-4-nitro-benzoic acid [2-(morpholinomethyl)benzyl] ester hydrochloride Formula: C19H20Cl2N2O5 MolecularWeight: 427.2785

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CC=CC=C2COC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl.Cl

Isomeric SMILES

C1COCCN1CC2=CC=CC=C2COC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl.Cl

InChI

InChI=1S/C19H19ClN2O5.ClH/c20-18-11-16(22(24)25)5-6-17(18)19(23)27-13-15-4-2-1-3-14(15)12-21-7-9-26-10-8-21;/h1-6,11H,7-10,12-13H2;1H