methyl 2-[(4-nitrophenyl)carbamoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[(4-nitrophenyl)carbamoylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[(4-nitrophenyl)carbamoylamino]-3-phenyl-propanoate CAS Name: 2-[[(4-nitroanilino)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[(4-nitrophenyl)carbamoylamino]-3-phenylpropanoate Traditional Name: 2-[(4-nitrophenyl)carbamoylamino]-3-phenyl-propionic acid methyl ester Formula: C17H17N3O5 MolecularWeight: 343.33398

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O5/c1-25-16(21)15(11-12-5-3-2-4-6-12)19-17(22)18-13-7-9-14(10-8-13)20(23)24/h2-10,15H,11H2,1H3,(H2,18,19,22)