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

Systemtic Name: (phenylmethyl) N-[(2S)-1-[(4-iodophenyl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[(4-iodophenyl)carbamoyl]-3-methyl-butyl]carbamate CAS Name: N-[(2S)-1-(4-iodoanilino)-4-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-(4-iodoanilino)-4-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(4-iodophenyl)carbamoyl]-3-methyl-butyl]carbamic acid benzyl ester Formula: C20H23IN2O3 MolecularWeight: 466.31269

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC=C(C=C1)I)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC1=CC=C(C=C1)I)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H23IN2O3/c1-14(2)12-18(19(24)22-17-10-8-16(21)9-11-17)23-20(25)26-13-15-6-4-3-5-7-15/h3-11,14,18H,12-13H2,1-2H3,(H,22,24)(H,23,25)/t18-/m0/s1