N-[(E)-1-(furan-2-yl)-3-(2-morpholin-4-ium-4-ylethylamino)-3-oxidanylidene-prop-1-en-2-yl]-4-methoxy-benzamide

Systemtic Name: N-[(E)-1-(furan-2-yl)-3-(2-morpholin-4-ium-4-ylethylamino)-3-oxidanylidene-prop-1-en-2-yl]-4-methoxy-benzamide Openeye Name: N-[(E)-2-(2-furyl)-1-(2-morpholin-4-ium-4-ylethylcarbamoyl)vinyl]-4-methoxy-benzamide CAS Name: N-[(E)-1-(2-furanyl)-3-[2-(4-morpholin-4-iumyl)ethylamino]-3-oxoprop-1-en-2-yl]-4-methoxybenzamide IUPAC Name: N-[(E)-1-(furan-2-yl)-3-(2-morpholin-4-ium-4-ylethylamino)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide Traditional Name: N-[(E)-2-(2-furyl)-1-(2-morpholin-4-ium-4-ylethylcarbamoyl)vinyl]-4-methoxy-benzamide Formula: C21H26N3O5+ MolecularWeight: 400.44824

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(=CC2=CC=CO2)C(=O)NCC[NH+]3CCOCC3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N/C(=C/C2=CC=CO2)/C(=O)NCC[NH+]3CCOCC3

InChI

InChI=1S/C21H25N3O5/c1-27-17-6-4-16(5-7-17)20(25)23-19(15-18-3-2-12-29-18)21(26)22-8-9-24-10-13-28-14-11-24/h2-7,12,15H,8-11,13-14H2,1H3,(H,22,26)(H,23,25)/p+1/b19-15+