6-bromanyl-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-2H-chromene-3-carboxamide

Systemtic Name: 6-bromanyl-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]-2H-chromene-3-carboxamide Openeye Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-6-bromo-2H-chromene-3-carboxamide CAS Name: 6-bromo-N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]-2H-1-benzopyran-3-carboxamide IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-6-bromo-2H-chromene-3-carboxamide Traditional Name: N-[3-(4-benzylpiperazino)propyl]-6-bromo-2H-chromene-3-carboxamide Formula: C24H28BrN3O2 MolecularWeight: 470.40202

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)C2=CC3=C(C=CC(=C3)Br)OC2)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCCNC(=O)C2=CC3=C(C=CC(=C3)Br)OC2)CC4=CC=CC=C4

InChI

InChI=1S/C24H28BrN3O2/c25-22-7-8-23-20(16-22)15-21(18-30-23)24(29)26-9-4-10-27-11-13-28(14-12-27)17-19-5-2-1-3-6-19/h1-3,5-8,15-16H,4,9-14,17-18H2,(H,26,29)