N-[(E)-(3-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-4-nitro-aniline

Systemtic Name: N-[(E)-(3-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-4-nitro-aniline Openeye Name: N-[(E)-(3-methoxy-4-prop-2-ynoxy-phenyl)methyleneamino]-4-nitro-aniline CAS Name: N-[(E)-(3-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]-4-nitroaniline IUPAC Name: N-[(E)-(3-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]-4-nitroaniline Traditional Name: [(E)-(3-methoxy-4-propargyloxy-benzylidene)amino]-(4-nitrophenyl)amine Formula: C17H15N3O4 MolecularWeight: 325.3187

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC2=CC=C(C=C2)[N+](=O)[O-])OCC#C

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC2=CC=C(C=C2)[N+](=O)[O-])OCC#C

InChI

InChI=1S/C17H15N3O4/c1-3-10-24-16-9-4-13(11-17(16)23-2)12-18-19-14-5-7-15(8-6-14)20(21)22/h1,4-9,11-12,19H,10H2,2H3/b18-12+