methyl 2-[4-[2-[(3-butylazulen-1-yl)sulfonylamino]ethyl]phenoxy]ethanoate

Systemtic Name: methyl 2-[4-[2-[(3-butylazulen-1-yl)sulfonylamino]ethyl]phenoxy]ethanoate Openeye Name: methyl 2-[4-[2-[(3-butylazulen-1-yl)sulfonylamino]ethyl]phenoxy]acetate CAS Name: 2-[4-[2-[(3-butyl-1-azulenyl)sulfonylamino]ethyl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[2-[(3-butylazulen-1-yl)sulfonylamino]ethyl]phenoxy]acetate Traditional Name: 2-[4-[2-[(3-butylazulen-1-yl)sulfonylamino]ethyl]phenoxy]acetic acid methyl ester Formula: C25H29NO5S MolecularWeight: 455.56646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C2C1=CC=CC=C2)S(=O)(=O)NCCC3=CC=C(C=C3)OCC(=O)OC

Isomeric SMILES

CCCCC1=CC(=C2C1=CC=CC=C2)S(=O)(=O)NCCC3=CC=C(C=C3)OCC(=O)OC

InChI

InChI=1S/C25H29NO5S/c1-3-4-8-20-17-24(23-10-7-5-6-9-22(20)23)32(28,29)26-16-15-19-11-13-21(14-12-19)31-18-25(27)30-2/h5-7,9-14,17,26H,3-4,8,15-16,18H2,1-2H3