(phenylmethyl) N-[(2S)-1-[(2,5-dimethoxyphenyl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[(2,5-dimethoxyphenyl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[(2,5-dimethoxyphenyl)methylcarbamoyl]-2-methyl-propyl]carbamate CAS Name: N-[(2S)-1-[(2,5-dimethoxyphenyl)methylamino]-3-methyl-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[(2,5-dimethoxyphenyl)methylamino]-3-methyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(2,5-dimethoxybenzyl)carbamoyl]-2-methyl-propyl]carbamic acid benzyl ester Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=C(C=CC(=C1)OC)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=C(C=CC(=C1)OC)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H28N2O5/c1-15(2)20(24-22(26)29-14-16-8-6-5-7-9-16)21(25)23-13-17-12-18(27-3)10-11-19(17)28-4/h5-12,15,20H,13-14H2,1-4H3,(H,23,25)(H,24,26)/t20-/m0/s1