(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxidanylidene-ethyl]azanium Openeye Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-[2-[(2S)-2-ethyl-1-piperidyl]-2-oxo-ethyl]ammonium CAS Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-[2-[(2S)-2-ethyl-1-piperidinyl]-2-oxoethyl]ammonium IUPAC Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]azanium Traditional Name: ethyl-[2-[(2S)-2-ethylpiperidino]-2-keto-ethyl]-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methyl]ammonium Formula: C22H33N4O4+ MolecularWeight: 417.52182

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)C[NH+](CC)CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

Isomeric SMILES

CC[C@H]1CCCCN1C(=O)C[NH+](CC)CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

InChI

InChI=1S/C22H32N4O4/c1-5-15-9-7-8-10-26(15)21(27)14-25(6-2)13-20-23-17-12-19(30-4)18(29-3)11-16(17)22(28)24-20/h11-12,15H,5-10,13-14H2,1-4H3,(H,23,24,28)/p+1/t15-/m0/s1