(3S)-3-[(4-bromophenyl)sulfonylamino]-3-(4-propoxyphenyl)propanoate

Systemtic Name: (3S)-3-[(4-bromophenyl)sulfonylamino]-3-(4-propoxyphenyl)propanoate Openeye Name: (3S)-3-[(4-bromophenyl)sulfonylamino]-3-(4-propoxyphenyl)propanoate CAS Name: (3S)-3-[(4-bromophenyl)sulfonylamino]-3-(4-propoxyphenyl)propanoate IUPAC Name: (3S)-3-[(4-bromophenyl)sulfonylamino]-3-(4-propoxyphenyl)propanoate Traditional Name: (3S)-3-(brosylamino)-3-(4-propoxyphenyl)propionate Formula: C18H19BrNO5S- MolecularWeight: 441.31616

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(CC(=O)[O-])NS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCOC1=CC=C(C=C1)[C@H](CC(=O)[O-])NS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H20BrNO5S/c1-2-11-25-15-7-3-13(4-8-15)17(12-18(21)22)20-26(23,24)16-9-5-14(19)6-10-16/h3-10,17,20H,2,11-12H2,1H3,(H,21,22)/p-1/t17-/m0/s1