N-(9-ethylcarbazol-3-yl)-2-isoquinolin-2-ium-2-yl-ethanamide

Systemtic Name: N-(9-ethylcarbazol-3-yl)-2-isoquinolin-2-ium-2-yl-ethanamide Openeye Name: N-(9-ethylcarbazol-3-yl)-2-isoquinolin-2-ium-2-yl-acetamide CAS Name: N-(9-ethyl-3-carbazolyl)-2-(2-isoquinolin-2-iumyl)acetamide IUPAC Name: N-(9-ethylcarbazol-3-yl)-2-isoquinolin-2-ium-2-ylacetamide Traditional Name: N-(9-ethylcarbazol-3-yl)-2-isoquinolin-2-ium-2-yl-acetamide Formula: C25H22N3O+ MolecularWeight: 380.46168

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C[N+]3=CC4=CC=CC=C4C=C3)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C[N+]3=CC4=CC=CC=C4C=C3)C5=CC=CC=C51

InChI

InChI=1S/C25H21N3O/c1-2-28-23-10-6-5-9-21(23)22-15-20(11-12-24(22)28)26-25(29)17-27-14-13-18-7-3-4-8-19(18)16-27/h3-16H,2,17H2,1H3/p+1