methyl 4-[4-(2-azanylethanoylamino)phenyl]sulfinylbenzoate

Systemtic Name: methyl 4-[4-(2-azanylethanoylamino)phenyl]sulfinylbenzoate Openeye Name: methyl 4-[4-[(2-aminoacetyl)amino]phenyl]sulfinylbenzoate CAS Name: 4-[4-[(2-amino-1-oxoethyl)amino]phenyl]sulfinylbenzoic acid methyl ester IUPAC Name: methyl 4-[4-[(2-aminoacetyl)amino]phenyl]sulfinylbenzoate Traditional Name: 4-[4-(glycylamino)phenyl]sulfinylbenzoic acid methyl ester Formula: C16H16N2O4S MolecularWeight: 332.37424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)S(=O)C2=CC=C(C=C2)NC(=O)CN

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)S(=O)C2=CC=C(C=C2)NC(=O)CN

InChI

InChI=1S/C16H16N2O4S/c1-22-16(20)11-2-6-13(7-3-11)23(21)14-8-4-12(5-9-14)18-15(19)10-17/h2-9H,10,17H2,1H3,(H,18,19)