N-[2-[4-(4-hydroxyphenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-3,4-dimethyl-benzamide

Systemtic Name: N-[2-[4-(4-hydroxyphenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-3,4-dimethyl-benzamide Openeye Name: N-[2-[4-(4-hydroxybenzoyl)piperazin-1-yl]-2-oxo-ethyl]-3,4-dimethyl-benzamide CAS Name: N-[2-[4-[(4-hydroxyphenyl)-oxomethyl]-1-piperazinyl]-2-oxoethyl]-3,4-dimethylbenzamide IUPAC Name: N-[2-[4-(4-hydroxybenzoyl)piperazin-1-yl]-2-oxoethyl]-3,4-dimethylbenzamide Traditional Name: N-[2-[4-(4-hydroxybenzoyl)piperazino]-2-keto-ethyl]-3,4-dimethyl-benzamide Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)O)C

InChI

InChI=1S/C22H25N3O4/c1-15-3-4-18(13-16(15)2)21(28)23-14-20(27)24-9-11-25(12-10-24)22(29)17-5-7-19(26)8-6-17/h3-8,13,26H,9-12,14H2,1-2H3,(H,23,28)