(Z)-2-diazonio-1-ethoxy-3-[3-methylhept-6-enoyl-(phenylmethyl)amino]-3-oxidanylidene-prop-1-en-1-olate

Systemtic Name: (Z)-2-diazonio-1-ethoxy-3-[3-methylhept-6-enoyl-(phenylmethyl)amino]-3-oxidanylidene-prop-1-en-1-olate Openeye Name: (Z)-3-[benzyl(3-methylhept-6-enoyl)amino]-2-diazonio-1-ethoxy-3-oxo-prop-1-en-1-olate CAS Name: (Z)-2-diazonio-1-ethoxy-3-[(3-methyl-1-oxohept-6-enyl)-(phenylmethyl)amino]-3-oxo-1-propen-1-olate IUPAC Name: (Z)-3-[benzyl(3-methylhept-6-enoyl)amino]-2-diazonio-1-ethoxy-3-oxoprop-1-en-1-olate Traditional Name: (Z)-3-[benzyl(3-methylhept-6-enoyl)amino]-2-diazonio-1-ethoxy-3-keto-prop-1-en-1-olate Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)N(CC1=CC=CC=C1)C(=O)CC(C)CCC=C)[N+]#N)[O-]

Isomeric SMILES

CCO/C(=C(/C(=O)N(CC1=CC=CC=C1)C(=O)CC(C)CCC=C)\[N+]#N)/[O-]

InChI

InChI=1S/C20H25N3O4/c1-4-6-10-15(3)13-17(24)23(14-16-11-8-7-9-12-16)19(25)18(22-21)20(26)27-5-2/h4,7-9,11-12,15H,1,5-6,10,13-14H2,2-3H3