[5-[[methyl(phenyl)amino]methyl]furan-2-yl]-piperazin-4-ium-1-yl-methanone

Systemtic Name: [5-[[methyl(phenyl)amino]methyl]furan-2-yl]-piperazin-4-ium-1-yl-methanone Openeye Name: [5-[(N-methylanilino)methyl]-2-furyl]-piperazin-4-ium-1-yl-methanone CAS Name: [5-[(N-methylanilino)methyl]-2-furanyl]-(1-piperazin-4-iumyl)methanone IUPAC Name: [5-[(N-methylanilino)methyl]furan-2-yl]-piperazin-4-ium-1-ylmethanone Traditional Name: [5-[(N-methylanilino)methyl]-2-furyl]-piperazin-4-ium-1-yl-methanone Formula: C17H22N3O2+ MolecularWeight: 300.37548

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(O1)C(=O)N2CC[NH2+]CC2)C3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC=C(O1)C(=O)N2CC[NH2+]CC2)C3=CC=CC=C3

InChI

InChI=1S/C17H21N3O2/c1-19(14-5-3-2-4-6-14)13-15-7-8-16(22-15)17(21)20-11-9-18-10-12-20/h2-8,18H,9-13H2,1H3/p+1