[2-(4-ethanoylpiperazin-1-yl)pyridin-3-yl]methyl-[(6-methoxy-2H-chromen-3-yl)methyl]azanium

Systemtic Name: [2-(4-ethanoylpiperazin-1-yl)pyridin-3-yl]methyl-[(6-methoxy-2H-chromen-3-yl)methyl]azanium Openeye Name: [2-(4-acetylpiperazin-1-yl)-3-pyridyl]methyl-[(6-methoxy-2H-chromen-3-yl)methyl]ammonium CAS Name: [2-(4-acetyl-1-piperazinyl)-3-pyridinyl]methyl-[(6-methoxy-2H-1-benzopyran-3-yl)methyl]ammonium IUPAC Name: [2-(4-acetylpiperazin-1-yl)pyridin-3-yl]methyl-[(6-methoxy-2H-chromen-3-yl)methyl]azanium Traditional Name: [2-(4-acetylpiperazino)-3-pyridyl]methyl-[(6-methoxy-2H-chromen-3-yl)methyl]ammonium Formula: C23H29N4O3+ MolecularWeight: 409.50136

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=CC=N2)C[NH2+]CC3=CC4=C(C=CC(=C4)OC)OC3

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=CC=N2)C[NH2+]CC3=CC4=C(C=CC(=C4)OC)OC3

InChI

InChI=1S/C23H28N4O3/c1-17(28)26-8-10-27(11-9-26)23-19(4-3-7-25-23)15-24-14-18-12-20-13-21(29-2)5-6-22(20)30-16-18/h3-7,12-13,24H,8-11,14-16H2,1-2H3/p+1