1-[(E)-3-(3-azanylnaphthalen-2-yl)-2-methyl-prop-2-enoyl]oxy-2,5-bis(oxidanylidene)pyrrolidine-3-sulfonic acid

Systemtic Name: 1-[(E)-3-(3-azanylnaphthalen-2-yl)-2-methyl-prop-2-enoyl]oxy-2,5-bis(oxidanylidene)pyrrolidine-3-sulfonic acid Openeye Name: 1-[(E)-3-(3-amino-2-naphthyl)-2-methyl-prop-2-enoyl]oxy-2,5-dioxo-pyrrolidine-3-sulfonic acid CAS Name: 1-[(E)-3-(3-amino-2-naphthalenyl)-2-methyl-1-oxoprop-2-enoxy]-2,5-dioxo-3-pyrrolidinesulfonic acid IUPAC Name: 1-[(E)-3-(3-aminonaphthalen-2-yl)-2-methylprop-2-enoyl]oxy-2,5-dioxopyrrolidine-3-sulfonic acid Traditional Name: 1-[(E)-3-(3-amino-2-naphthyl)-2-methyl-acryloyl]oxy-2,5-diketo-pyrrolidine-3-sulfonic acid Formula: C18H16N2O7S MolecularWeight: 404.39384

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC2=CC=CC=C2C=C1N)C(=O)ON3C(=O)CC(C3=O)S(=O)(=O)O

Isomeric SMILES

C/C(=C\C1=CC2=CC=CC=C2C=C1N)/C(=O)ON3C(=O)CC(C3=O)S(=O)(=O)O

InChI

InChI=1S/C18H16N2O7S/c1-10(6-13-7-11-4-2-3-5-12(11)8-14(13)19)18(23)27-20-16(21)9-15(17(20)22)28(24,25)26/h2-8,15H,9,19H2,1H3,(H,24,25,26)/b10-6+