[(1R,3S)-3-[(1S)-1-azanyl-2-oxidanylidene-2-pyrrolidin-1-yl-ethyl]cyclohexyl] N-(4-iodophenyl)carbamate

Systemtic Name: [(1R,3S)-3-[(1S)-1-azanyl-2-oxidanylidene-2-pyrrolidin-1-yl-ethyl]cyclohexyl] N-(4-iodophenyl)carbamate Openeye Name: [(1R,3S)-3-[(1S)-1-amino-2-oxo-2-pyrrolidin-1-yl-ethyl]cyclohexyl] N-(4-iodophenyl)carbamate CAS Name: N-(4-iodophenyl)carbamic acid [(1R,3S)-3-[(1S)-1-amino-2-oxo-2-(1-pyrrolidinyl)ethyl]cyclohexyl] ester IUPAC Name: [(1R,3S)-3-[(1S)-1-amino-2-oxo-2-pyrrolidin-1-ylethyl]cyclohexyl] N-(4-iodophenyl)carbamate Traditional Name: N-(4-iodophenyl)carbamic acid [(1R,3S)-3-[(1S)-1-amino-2-keto-2-pyrrolidino-ethyl]cyclohexyl] ester Formula: C19H26IN3O3 MolecularWeight: 471.33251

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(C2CCCC(C2)OC(=O)NC3=CC=C(C=C3)I)N

Isomeric SMILES

C1CCN(C1)C(=O)[C@H]([C@H]2CCC[C@H](C2)OC(=O)NC3=CC=C(C=C3)I)N

InChI

InChI=1S/C19H26IN3O3/c20-14-6-8-15(9-7-14)22-19(25)26-16-5-3-4-13(12-16)17(21)18(24)23-10-1-2-11-23/h6-9,13,16-17H,1-5,10-12,21H2,(H,22,25)/t13-,16+,17-/m0/s1