(phenylmethyl) N-[(2S)-1-[(1-cyclopropylpiperidin-4-yl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[(1-cyclopropylpiperidin-4-yl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[(1-cyclopropyl-4-piperidyl)carbamoyl]-2-methyl-propyl]carbamate CAS Name: N-[(2S)-1-[(1-cyclopropyl-4-piperidinyl)amino]-3-methyl-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[(1-cyclopropylpiperidin-4-yl)amino]-3-methyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(1-cyclopropyl-4-piperidyl)carbamoyl]-2-methyl-propyl]carbamic acid benzyl ester Formula: C21H31N3O3 MolecularWeight: 373.48914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1CCN(CC1)C2CC2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1CCN(CC1)C2CC2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H31N3O3/c1-15(2)19(23-21(26)27-14-16-6-4-3-5-7-16)20(25)22-17-10-12-24(13-11-17)18-8-9-18/h3-7,15,17-19H,8-14H2,1-2H3,(H,22,25)(H,23,26)/t19-/m0/s1