(phenylmethyl) N-[(2S)-1-[(1-ethanoyl-3-oxidanylidene-piperidin-4-yl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[(1-ethanoyl-3-oxidanylidene-piperidin-4-yl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[(1-acetyl-3-oxo-4-piperidyl)carbamoyl]-3-methyl-butyl]carbamate CAS Name: N-[(2S)-1-[(1-acetyl-3-oxo-4-piperidinyl)amino]-4-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[(1-acetyl-3-oxopiperidin-4-yl)amino]-4-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(1-acetyl-3-keto-4-piperidyl)carbamoyl]-3-methyl-butyl]carbamic acid benzyl ester Formula: C21H29N3O5 MolecularWeight: 403.47206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1CCN(CC1=O)C(=O)C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC1CCN(CC1=O)C(=O)C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H29N3O5/c1-14(2)11-18(23-21(28)29-13-16-7-5-4-6-8-16)20(27)22-17-9-10-24(15(3)25)12-19(17)26/h4-8,14,17-18H,9-13H2,1-3H3,(H,22,27)(H,23,28)/t17?,18-/m0/s1