2-[[[4-(ethylaminooxymethyl)phenyl]amino]methoxy]-5-[[4-(ethylcarbamoyl)phenyl]carbamoyl]benzenesulfonic acid

Systemtic Name: 2-[[[4-(ethylaminooxymethyl)phenyl]amino]methoxy]-5-[[4-(ethylcarbamoyl)phenyl]carbamoyl]benzenesulfonic acid Openeye Name: 2-[[4-(ethylaminooxymethyl)anilino]methoxy]-5-[[4-(ethylcarbamoyl)phenyl]carbamoyl]benzenesulfonic acid CAS Name: 2-[[4-(ethylaminooxymethyl)anilino]methoxy]-5-[[4-(ethylcarbamoyl)anilino]-oxomethyl]benzenesulfonic acid IUPAC Name: 2-[[4-(ethylaminooxymethyl)anilino]methoxy]-5-[[4-(ethylcarbamoyl)phenyl]carbamoyl]benzenesulfonic acid Traditional Name: 2-[[4-(ethylaminooxymethyl)anilino]methoxy]-5-[[4-(ethylcarbamoyl)phenyl]carbamoyl]besylic acid Formula: C26H30N4O7S MolecularWeight: 542.604

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)OCNC3=CC=C(C=C3)CONCC)S(=O)(=O)O

Isomeric SMILES

CCNC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)OCNC3=CC=C(C=C3)CONCC)S(=O)(=O)O

InChI

InChI=1S/C26H30N4O7S/c1-3-27-25(31)19-7-12-22(13-8-19)30-26(32)20-9-14-23(24(15-20)38(33,34)35)36-17-28-21-10-5-18(6-11-21)16-37-29-4-2/h5-15,28-29H,3-4,16-17H2,1-2H3,(H,27,31)(H,30,32)(H,33,34,35)