2-[(Z)-(1-aminocarbonyl-5-chloranyl-2-oxidanylidene-indol-3-ylidene)-prop-2-enoyloxy-methyl]thiophene-3-carboxylic acid

Systemtic Name: 2-[(Z)-(1-aminocarbonyl-5-chloranyl-2-oxidanylidene-indol-3-ylidene)-prop-2-enoyloxy-methyl]thiophene-3-carboxylic acid Openeye Name: 2-[(Z)-(1-carbamoyl-5-chloro-2-oxo-indolin-3-ylidene)-prop-2-enoyloxy-methyl]thiophene-3-carboxylic acid CAS Name: 2-[(Z)-(1-carbamoyl-5-chloro-2-oxo-3-indolylidene)-(1-oxoprop-2-enoxy)methyl]-3-thiophenecarboxylic acid IUPAC Name: 2-[(Z)-(1-carbamoyl-5-chloro-2-oxoindol-3-ylidene)-prop-2-enoyloxymethyl]thiophene-3-carboxylic acid Traditional Name: 2-[(Z)-acryloyloxy-(1-carbamoyl-5-chloro-2-keto-indolin-3-ylidene)methyl]-3-thenoic acid Formula: C18H11ClN2O6S MolecularWeight: 418.80774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)OC(=C1C2=C(C=CC(=C2)Cl)N(C1=O)C(=O)N)C3=C(C=CS3)C(=O)O

Isomeric SMILES

C=CC(=O)O/C(=C\1/C2=C(C=CC(=C2)Cl)N(C1=O)C(=O)N)/C3=C(C=CS3)C(=O)O

InChI

InChI=1S/C18H11ClN2O6S/c1-2-12(22)27-14(15-9(17(24)25)5-6-28-15)13-10-7-8(19)3-4-11(10)21(16(13)23)18(20)26/h2-7H,1H2,(H2,20,26)(H,24,25)/b14-13-