[2-oxidanylidene-2-[phenethyl-(phenylmethyl)amino]ethyl] 4-iodanylbenzoate

Systemtic Name: [2-oxidanylidene-2-[phenethyl-(phenylmethyl)amino]ethyl] 4-iodanylbenzoate Openeye Name: [2-[benzyl(phenethyl)amino]-2-oxo-ethyl] 4-iodobenzoate CAS Name: 4-iodobenzoic acid [2-oxo-2-[phenethyl-(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-[benzyl(phenethyl)amino]-2-oxoethyl] 4-iodobenzoate Traditional Name: 4-iodobenzoic acid [2-[benzyl(phenethyl)amino]-2-keto-ethyl] ester Formula: C24H22INO3 MolecularWeight: 499.34085

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)COC(=O)C3=CC=C(C=C3)I

Isomeric SMILES

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)COC(=O)C3=CC=C(C=C3)I

InChI

InChI=1S/C24H22INO3/c25-22-13-11-21(12-14-22)24(28)29-18-23(27)26(17-20-9-5-2-6-10-20)16-15-19-7-3-1-4-8-19/h1-14H,15-18H2