(4-methoxyphenyl)methyl N-[[4-oxidanylidene-4-(1-phenylethylamino)but-1-en-2-yl]amino]carbamate

Systemtic Name: (4-methoxyphenyl)methyl N-[[4-oxidanylidene-4-(1-phenylethylamino)but-1-en-2-yl]amino]carbamate Openeye Name: (4-methoxyphenyl)methyl N-[[1-methylene-3-oxo-3-(1-phenylethylamino)propyl]amino]carbamate CAS Name: N-[[4-oxo-4-(1-phenylethylamino)but-1-en-2-yl]amino]carbamic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl N-[[4-oxo-4-(1-phenylethylamino)but-1-en-2-yl]amino]carbamate Traditional Name: N-[1-[2-keto-2-(1-phenylethylamino)ethyl]vinylamino]carbamic acid p-anisyl ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CC(=C)NNC(=O)OCC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)CC(=C)NNC(=O)OCC2=CC=C(C=C2)OC

InChI

InChI=1S/C21H25N3O4/c1-15(13-20(25)22-16(2)18-7-5-4-6-8-18)23-24-21(26)28-14-17-9-11-19(27-3)12-10-17/h4-12,16,23H,1,13-14H2,2-3H3,(H,22,25)(H,24,26)