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

Systemtic Name: (phenylmethyl) N-[(2S)-1-[(4-dimethylaminophenyl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[(4-dimethylaminophenyl)methylcarbamoyl]-2-methyl-propyl]carbamate CAS Name: N-[(2S)-1-[(4-dimethylaminophenyl)methylamino]-3-methyl-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[(4-dimethylaminophenyl)methylamino]-3-methyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[[4-(dimethylamino)benzyl]carbamoyl]-2-methyl-propyl]carbamic acid benzyl ester Formula: C22H29N3O3 MolecularWeight: 383.48396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O3/c1-16(2)20(24-22(27)28-15-18-8-6-5-7-9-18)21(26)23-14-17-10-12-19(13-11-17)25(3)4/h5-13,16,20H,14-15H2,1-4H3,(H,23,26)(H,24,27)/t20-/m0/s1