(2S)-N-(ethylcarbamoyl)-2-phenyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide

Systemtic Name: (2S)-N-(ethylcarbamoyl)-2-phenyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide Openeye Name: (2S)-N-(ethylcarbamoyl)-2-phenyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide CAS Name: (2S)-N-(ethylcarbamoyl)-2-phenyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide IUPAC Name: (2S)-N-(ethylcarbamoyl)-2-phenyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Traditional Name: (2S)-N-(ethylcarbamoyl)-2-phenyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Formula: C20H24N3O2+ MolecularWeight: 338.42346

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C1=CC=CC=C1)[NH+]2CCC3=CC=CC=C3C2

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C1=CC=CC=C1)[NH+]2CCC3=CC=CC=C3C2

InChI

InChI=1S/C20H23N3O2/c1-2-21-20(25)22-19(24)18(16-9-4-3-5-10-16)23-13-12-15-8-6-7-11-17(15)14-23/h3-11,18H,2,12-14H2,1H3,(H2,21,22,24,25)/p+1/t18-/m0/s1