tert-butyl N-[(E)-[4-[(2-cyanophenyl)amino]-4-oxidanylidene-butan-2-ylidene]amino]carbamate

Systemtic Name: tert-butyl N-[(E)-[4-[(2-cyanophenyl)amino]-4-oxidanylidene-butan-2-ylidene]amino]carbamate Openeye Name: tert-butyl N-[(E)-[3-(2-cyanoanilino)-1-methyl-3-oxo-propylidene]amino]carbamate CAS Name: N-[(E)-[4-(2-cyanoanilino)-4-oxobutan-2-ylidene]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E)-[4-(2-cyanoanilino)-4-oxobutan-2-ylidene]amino]carbamate Traditional Name: N-[(E)-[3-(2-cyanoanilino)-3-keto-1-methyl-propylidene]amino]carbamic acid tert-butyl ester Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)OC(C)(C)C)CC(=O)NC1=CC=CC=C1C#N

Isomeric SMILES

C/C(=N\NC(=O)OC(C)(C)C)/CC(=O)NC1=CC=CC=C1C#N

InChI

InChI=1S/C16H20N4O3/c1-11(19-20-15(22)23-16(2,3)4)9-14(21)18-13-8-6-5-7-12(13)10-17/h5-8H,9H2,1-4H3,(H,18,21)(H,20,22)/b19-11+