decanedioate; quinolin-1-ium

Systemtic Name: decanedioate; quinolin-1-ium Openeye Name: decanedioate; quinolin-1-ium CAS Name: decanedioate; quinolin-1-ium IUPAC Name: decanedioate; quinolin-1-ium Traditional Name: quinolin-1-ium; sebacate Formula: C28H32N2O4 MolecularWeight: 460.56468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=[NH+]2.C1=CC=C2C(=C1)C=CC=[NH+]2.C(CCCCC(=O)[O-])CCCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=[NH+]2.C1=CC=C2C(=C1)C=CC=[NH+]2.C(CCCCC(=O)[O-])CCCC(=O)[O-]

InChI

InChI=1S/C10H18O4.2C9H7N/c11-9(12)7-5-3-1-2-4-6-8-10(13)14;2*1-2-6-9-8(4-1)5-3-7-10-9/h1-8H2,(H,11,12)(H,13,14);2*1-7H