1-[2-[4-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]phenyl]ethanoyl]-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide

Systemtic Name: 1-[2-[4-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]phenyl]ethanoyl]-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide Openeye Name: 1-[2-[4-(2,4-dioxo-1H-quinazolin-3-yl)phenyl]acetyl]-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide CAS Name: 1-[2-[4-(2,4-dioxo-1H-quinazolin-3-yl)phenyl]-1-oxoethyl]-4-(1-piperidin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-[4-(2,4-dioxo-1H-quinazolin-3-yl)phenyl]acetyl]-4-piperidin-1-ium-1-ylpiperidine-4-carboxamide Traditional Name: 1-[2-[4-(2,4-diketo-1H-quinazolin-3-yl)phenyl]acetyl]-4-piperidin-1-ium-1-yl-isonipecotamide Formula: C27H32N5O4+ MolecularWeight: 490.57408

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2(CCN(CC2)C(=O)CC3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5NC4=O)C(=O)N

Isomeric SMILES

C1CC[NH+](CC1)C2(CCN(CC2)C(=O)CC3=CC=C(C=C3)N4C(=O)C5=CC=CC=C5NC4=O)C(=O)N

InChI

InChI=1S/C27H31N5O4/c28-25(35)27(31-14-4-1-5-15-31)12-16-30(17-13-27)23(33)18-19-8-10-20(11-9-19)32-24(34)21-6-2-3-7-22(21)29-26(32)36/h2-3,6-11H,1,4-5,12-18H2,(H2,28,35)(H,29,36)/p+1