(phenylmethyl) N-[(2S)-1-(benzotriazol-1-yl)-3-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-(benzotriazol-1-yl)-3-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-(benzotriazole-1-carbonyl)-2-methyl-butyl]carbamate CAS Name: N-[(2S)-1-(1-benzotriazolyl)-3-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-(benzotriazol-1-yl)-3-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[(1S)-1-(benzotriazole-1-carbonyl)-2-methyl-butyl]carbamic acid benzyl ester Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1C2=CC=CC=C2N=N1)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCC(C)[C@@H](C(=O)N1C2=CC=CC=C2N=N1)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O3/c1-3-14(2)18(21-20(26)27-13-15-9-5-4-6-10-15)19(25)24-17-12-8-7-11-16(17)22-23-24/h4-12,14,18H,3,13H2,1-2H3,(H,21,26)/t14?,18-/m0/s1