N-(4-oxidanylidene-3-phenyl-chromen-2-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(4-oxidanylidene-3-phenyl-chromen-2-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(4-oxo-3-phenyl-chromen-2-yl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(4-oxo-3-phenyl-1-benzopyran-2-yl)-2-(4-phenyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(4-oxo-3-phenylchromen-2-yl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(4-keto-3-phenyl-chromen-2-yl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Formula: C27H26N3O3+ MolecularWeight: 440.51364

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=C(C(=O)C3=CC=CC=C3O2)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=C(C(=O)C3=CC=CC=C3O2)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H25N3O3/c31-24(19-29-15-17-30(18-16-29)21-11-5-2-6-12-21)28-27-25(20-9-3-1-4-10-20)26(32)22-13-7-8-14-23(22)33-27/h1-14H,15-19H2,(H,28,31)/p+1