(2S)-2-[(S)-[(4-iodophenyl)amino]-phenyl-methyl]cyclopentan-1-one

Systemtic Name: (2S)-2-[(S)-[(4-iodophenyl)amino]-phenyl-methyl]cyclopentan-1-one Openeye Name: (2S)-2-[(S)-(4-iodoanilino)-phenyl-methyl]cyclopentanone CAS Name: (2S)-2-[(S)-(4-iodoanilino)-phenylmethyl]-1-cyclopentanone IUPAC Name: (2S)-2-[(S)-(4-iodoanilino)-phenylmethyl]cyclopentan-1-one Traditional Name: (2S)-2-[(S)-(4-iodoanilino)-phenyl-methyl]cyclopentanone Formula: C18H18INO MolecularWeight: 391.24609

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)C1)C(C2=CC=CC=C2)NC3=CC=C(C=C3)I

Isomeric SMILES

C1C[C@H](C(=O)C1)[C@@H](C2=CC=CC=C2)NC3=CC=C(C=C3)I

InChI

InChI=1S/C18H18INO/c19-14-9-11-15(12-10-14)20-18(13-5-2-1-3-6-13)16-7-4-8-17(16)21/h1-3,5-6,9-12,16,18,20H,4,7-8H2/t16-,18-/m1/s1