methyl 2-[(4-aminophenyl)sulfonylamino]-6-methoxy-hex-4-ynoate

Systemtic Name: methyl 2-[(4-aminophenyl)sulfonylamino]-6-methoxy-hex-4-ynoate Openeye Name: methyl 2-[(4-aminophenyl)sulfonylamino]-6-methoxy-hex-4-ynoate CAS Name: 2-[(4-aminophenyl)sulfonylamino]-6-methoxy-4-hexynoic acid methyl ester IUPAC Name: methyl 2-[(4-aminophenyl)sulfonylamino]-6-methoxyhex-4-ynoate Traditional Name: 6-methoxy-2-(sulfanilylamino)hex-4-ynoic acid methyl ester Formula: C14H18N2O5S MolecularWeight: 326.36812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC#CCC(C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)N

Isomeric SMILES

COCC#CCC(C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)N

InChI

InChI=1S/C14H18N2O5S/c1-20-10-4-3-5-13(14(17)21-2)16-22(18,19)12-8-6-11(15)7-9-12/h6-9,13,16H,5,10,15H2,1-2H3