tert-butyl N-[3-[(E)-3-(benzotriazol-1-yl)-3-oxidanylidene-prop-1-enyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[3-[(E)-3-(benzotriazol-1-yl)-3-oxidanylidene-prop-1-enyl]phenyl]carbamate Openeye Name: tert-butyl N-[3-[(E)-3-(benzotriazol-1-yl)-3-oxo-prop-1-enyl]phenyl]carbamate CAS Name: N-[3-[(E)-3-(1-benzotriazolyl)-3-oxoprop-1-enyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[(E)-3-(benzotriazol-1-yl)-3-oxoprop-1-enyl]phenyl]carbamate Traditional Name: N-[3-[(E)-3-(benzotriazol-1-yl)-3-keto-prop-1-enyl]phenyl]carbamic acid tert-butyl ester Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=CC(=C1)C=CC(=O)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=CC(=C1)/C=C/C(=O)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C20H20N4O3/c1-20(2,3)27-19(26)21-15-8-6-7-14(13-15)11-12-18(25)24-17-10-5-4-9-16(17)22-23-24/h4-13H,1-3H3,(H,21,26)/b12-11+