pentanedioate; quinolin-1-ium

Systemtic Name: pentanedioate; quinolin-1-ium Openeye Name: pentanedioate; quinolin-1-ium CAS Name: pentanedioate; quinolin-1-ium IUPAC Name: pentanedioate; quinolin-1-ium Traditional Name: glutarate; quinolin-1-ium Formula: C23H22N2O4 MolecularWeight: 390.43178

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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(CC(=O)[O-])CC(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/2C9H7N.C5H8O4/c2*1-2-6-9-8(4-1)5-3-7-10-9;6-4(7)2-1-3-5(8)9/h2*1-7H;1-3H2,(H,6,7)(H,8,9)