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7-[4-(prop-2-enoylamino)butoxy]naphthalene-1,3-disulfonic acid

7-[4-(prop-2-enoylamino)butoxy]naphthalene-1,3-disulfonic acid

Systemtic Name:7-[4-(prop-2-enoylamino)butoxy]naphthalene-1,3-disulfonic acid
Openeye Name:7-[4-(prop-2-enoylamino)butoxy]naphthalene-1,3-disulfonic acid
CAS Name:7-[4-(1-oxoprop-2-enylamino)butoxy]naphthalene-1,3-disulfonic acid
IUPAC Name:7-[4-(prop-2-enoylamino)butoxy]naphthalene-1,3-disulfonic acid
Traditional Name:7-(4-acrylamidobutoxy)naphthalene-1,3-disulfonic acid
Formula: C17H19NO8S2
MolecularWeight: 429.46466
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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)NCCCCOC1=CC2=C(C=C(C=C2C=C1)S(=O)(=O)O)S(=O)(=O)O


Isomeric SMILES

C=CC(=O)NCCCCOC1=CC2=C(C=C(C=C2C=C1)S(=O)(=O)O)S(=O)(=O)O


InChI

InChI=1S/C17H19NO8S2/c1-2-17(19)18-7-3-4-8-26-13-6-5-12-9-14(27(20,21)22)11-16(15(12)10-13)28(23,24)25/h2,5-6,9-11H,1,3-4,7-8H2,(H,18,19)(H,20,21,22)(H,23,24,25)


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