N-[3-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-3-oxidanylidene-propyl]-4-bromanyl-benzamide

Systemtic Name: N-[3-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-3-oxidanylidene-propyl]-4-bromanyl-benzamide Openeye Name: N-[3-[3-(1,3-benzoxazol-2-yl)-1-piperidyl]-3-oxo-propyl]-4-bromo-benzamide CAS Name: N-[3-[3-(1,3-benzoxazol-2-yl)-1-piperidinyl]-3-oxopropyl]-4-bromobenzamide IUPAC Name: N-[3-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-3-oxopropyl]-4-bromobenzamide Traditional Name: N-[3-[3-(1,3-benzoxazol-2-yl)piperidino]-3-keto-propyl]-4-bromo-benzamide Formula: C22H22BrN3O3 MolecularWeight: 456.33238

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCNC(=O)C2=CC=C(C=C2)Br)C3=NC4=CC=CC=C4O3

Isomeric SMILES

C1CC(CN(C1)C(=O)CCNC(=O)C2=CC=C(C=C2)Br)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C22H22BrN3O3/c23-17-9-7-15(8-10-17)21(28)24-12-11-20(27)26-13-3-4-16(14-26)22-25-18-5-1-2-6-19(18)29-22/h1-2,5-10,16H,3-4,11-14H2,(H,24,28)