N-(9-ethylcarbazol-3-yl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)ethanamide

Systemtic Name: N-(9-ethylcarbazol-3-yl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)ethanamide Openeye Name: N-(9-ethylcarbazol-3-yl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)acetamide CAS Name: N-(9-ethyl-3-carbazolyl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)acetamide IUPAC Name: N-(9-ethylcarbazol-3-yl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)acetamide Traditional Name: N-(9-ethylcarbazol-3-yl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)acetamide Formula: C25H26N3O+ MolecularWeight: 384.49344

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C[N+]3=CC4=C(CCCC4)C=C3)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C[N+]3=CC4=C(CCCC4)C=C3)C5=CC=CC=C51

InChI

InChI=1S/C25H25N3O/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/h5-6,9-16H,2-4,7-8,17H2,1H3/p+1