methyl 3-[[5-iodanyl-2-(naphthalen-2-ylmethylamino)phenyl]carbonylamino]butanoate

Systemtic Name: methyl 3-[[5-iodanyl-2-(naphthalen-2-ylmethylamino)phenyl]carbonylamino]butanoate Openeye Name: methyl 3-[[5-iodo-2-(2-naphthylmethylamino)benzoyl]amino]butanoate CAS Name: 3-[[[5-iodo-2-(2-naphthalenylmethylamino)phenyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 3-[[5-iodo-2-(naphthalen-2-ylmethylamino)benzoyl]amino]butanoate Traditional Name: 3-[[5-iodo-2-(2-naphthylmethylamino)benzoyl]amino]butyric acid methyl ester Formula: C23H23IN2O3 MolecularWeight: 502.34479

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC)NC(=O)C1=C(C=CC(=C1)I)NCC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(CC(=O)OC)NC(=O)C1=C(C=CC(=C1)I)NCC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C23H23IN2O3/c1-15(11-22(27)29-2)26-23(28)20-13-19(24)9-10-21(20)25-14-16-7-8-17-5-3-4-6-18(17)12-16/h3-10,12-13,15,25H,11,14H2,1-2H3,(H,26,28)