methyl (2R)-3-(4-methoxy-3-nitro-phenyl)-2-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]propanoate

Systemtic Name: methyl (2R)-3-(4-methoxy-3-nitro-phenyl)-2-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]propanoate Openeye Name: methyl (2R)-3-(4-methoxy-3-nitro-phenyl)-2-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]propanoate CAS Name: (2R)-3-(4-methoxy-3-nitrophenyl)-2-[(6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]propanoic acid methyl ester IUPAC Name: methyl (2R)-3-(4-methoxy-3-nitrophenyl)-2-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]propanoate Traditional Name: (2R)-2-[(6-ketocyclohexa-2,4-dien-1-ylidene)methylamino]-3-(4-methoxy-3-nitro-phenyl)propionic acid methyl ester Formula: C18H18N2O6 MolecularWeight: 358.34532

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(C(=O)OC)NC=C2C=CC=CC2=O)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C[C@H](C(=O)OC)NC=C2C=CC=CC2=O)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O6/c1-25-17-8-7-12(10-15(17)20(23)24)9-14(18(22)26-2)19-11-13-5-3-4-6-16(13)21/h3-8,10-11,14,19H,9H2,1-2H3/t14-/m1/s1