1-[(2R)-2-[(4-iodophenyl)carbamoylamino]-3-phenyl-propanoyl]-N-(4-methoxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[(2R)-2-[(4-iodophenyl)carbamoylamino]-3-phenyl-propanoyl]-N-(4-methoxyphenyl)piperidine-4-carboxamide Openeye Name: 1-[(2R)-2-[(4-iodophenyl)carbamoylamino]-3-phenyl-propanoyl]-N-(4-methoxyphenyl)piperidine-4-carboxamide CAS Name: 1-[(2R)-2-[[(4-iodoanilino)-oxomethyl]amino]-1-oxo-3-phenylpropyl]-N-(4-methoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[(2R)-2-[(4-iodophenyl)carbamoylamino]-3-phenylpropanoyl]-N-(4-methoxyphenyl)piperidine-4-carboxamide Traditional Name: 1-[(2R)-2-[(4-iodophenyl)carbamoylamino]-3-phenyl-propanoyl]-N-(4-methoxyphenyl)isonipecotamide Formula: C29H31IN4O4 MolecularWeight: 626.48531

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C(=O)C(CC3=CC=CC=C3)NC(=O)NC4=CC=C(C=C4)I

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C(=O)[C@@H](CC3=CC=CC=C3)NC(=O)NC4=CC=C(C=C4)I

InChI

InChI=1S/C29H31IN4O4/c1-38-25-13-11-23(12-14-25)31-27(35)21-15-17-34(18-16-21)28(36)26(19-20-5-3-2-4-6-20)33-29(37)32-24-9-7-22(30)8-10-24/h2-14,21,26H,15-19H2,1H3,(H,31,35)(H2,32,33,37)/t26-/m1/s1