methyl 2-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[(4-morpholin-4-yl-3-nitro-phenyl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[(4-morpholino-3-nitro-benzoyl)amino]-3-phenyl-propanoate CAS Name: 2-[[[4-(4-morpholinyl)-3-nitrophenyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[(4-morpholin-4-yl-3-nitrobenzoyl)amino]-3-phenylpropanoate Traditional Name: 2-[(4-morpholino-3-nitro-benzoyl)amino]-3-phenyl-propionic acid methyl ester Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O6/c1-29-21(26)17(13-15-5-3-2-4-6-15)22-20(25)16-7-8-18(19(14-16)24(27)28)23-9-11-30-12-10-23/h2-8,14,17H,9-13H2,1H3,(H,22,25)