3,3-dimethyl-6-[4-(4-nitrophenyl)carbonylpiperazin-1-yl]-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile

Systemtic Name: 3,3-dimethyl-6-[4-(4-nitrophenyl)carbonylpiperazin-1-yl]-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Openeye Name: 3,3-dimethyl-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile CAS Name: 3,3-dimethyl-6-[4-[(4-nitrophenyl)-oxomethyl]-1-piperazinyl]-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile IUPAC Name: 3,3-dimethyl-6-[4-(4-nitrobenzoyl)piperazin-1-yl]-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Traditional Name: 3,3-dimethyl-6-[4-(4-nitrobenzoyl)piperazino]-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Formula: C28H28N5O4+ MolecularWeight: 498.55302

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=[NH+]C(=C2CO1)C3=CC=CC=C3)N4CCN(CC4)C(=O)C5=CC=C(C=C5)[N+](=O)[O-])C#N)C

Isomeric SMILES

CC1(CC2=C(C(=[NH+]C(=C2CO1)C3=CC=CC=C3)N4CCN(CC4)C(=O)C5=CC=C(C=C5)[N+](=O)[O-])C#N)C

InChI

InChI=1S/C28H27N5O4/c1-28(2)16-22-23(17-29)26(30-25(24(22)18-37-28)19-6-4-3-5-7-19)31-12-14-32(15-13-31)27(34)20-8-10-21(11-9-20)33(35)36/h3-11H,12-16,18H2,1-2H3/p+1