11-(2-acetamidoethyl)-3-chloranyl-6-oxidanylidene-isoindolo[2,1-a]indole-2-sulfonic acid

Systemtic Name: 11-(2-acetamidoethyl)-3-chloranyl-6-oxidanylidene-isoindolo[2,1-a]indole-2-sulfonic acid Openeye Name: 11-(2-acetamidoethyl)-3-chloro-6-oxo-isoindolo[2,1-a]indole-2-sulfonic acid CAS Name: 11-(2-acetamidoethyl)-3-chloro-6-oxo-2-isoindolo[2,1-a]indolesulfonic acid IUPAC Name: 11-(2-acetamidoethyl)-3-chloro-6-oxoisoindolo[2,1-a]indole-2-sulfonic acid Traditional Name: 11-(2-acetamidoethyl)-3-chloro-6-keto-isoindol[2,1-a]indole-2-sulfonic acid Formula: C19H15ClN2O5S MolecularWeight: 418.8508

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1=C2C3=CC=CC=C3C(=O)N2C4=CC(=C(C=C41)S(=O)(=O)O)Cl

Isomeric SMILES

CC(=O)NCCC1=C2C3=CC=CC=C3C(=O)N2C4=CC(=C(C=C41)S(=O)(=O)O)Cl

InChI

InChI=1S/C19H15ClN2O5S/c1-10(23)21-7-6-12-14-8-17(28(25,26)27)15(20)9-16(14)22-18(12)11-4-2-3-5-13(11)19(22)24/h2-5,8-9H,6-7H2,1H3,(H,21,23)(H,25,26,27)