N-[(2,3-dimethylphenyl)carbamoyl]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(2,3-dimethylphenyl)carbamoyl]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[(2,3-dimethylphenyl)carbamoyl]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[(2,3-dimethylanilino)-oxomethyl]-2-[4-(2-hydroxyphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(2,3-dimethylphenyl)carbamoyl]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[(2,3-dimethylphenyl)carbamoyl]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide Formula: C21H27N4O3+ MolecularWeight: 383.46408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3O)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3O)C

InChI

InChI=1S/C21H26N4O3/c1-15-6-5-7-17(16(15)2)22-21(28)23-20(27)14-24-10-12-25(13-11-24)18-8-3-4-9-19(18)26/h3-9,26H,10-14H2,1-2H3,(H2,22,23,27,28)/p+1