(phenylmethyl) N-[(2R,3S)-1-(4-ethylpiperazin-1-yl)-3-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2R,3S)-1-(4-ethylpiperazin-1-yl)-3-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[(1R,2S)-1-(4-ethylpiperazine-1-carbonyl)-2-methyl-butyl]carbamate CAS Name: N-[(2R,3S)-1-(4-ethyl-1-piperazinyl)-3-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2R,3S)-1-(4-ethylpiperazin-1-yl)-3-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[(1R,2S)-1-(4-ethylpiperazine-1-carbonyl)-2-methyl-butyl]carbamic acid benzyl ester Formula: C20H31N3O3 MolecularWeight: 361.47844

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(CC1)CC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)N1CCN(CC1)CC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H31N3O3/c1-4-16(3)18(19(24)23-13-11-22(5-2)12-14-23)21-20(25)26-15-17-9-7-6-8-10-17/h6-10,16,18H,4-5,11-15H2,1-3H3,(H,21,25)/t16-,18+/m0/s1