2-[[azanyl(2,3-dihydroindol-1-ium-1-ylidene)methyl]amino]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[[azanyl(2,3-dihydroindol-1-ium-1-ylidene)methyl]amino]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[[amino(indolin-1-ium-1-ylidene)methyl]amino]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[[amino(2,3-dihydroindol-1-ium-1-ylidene)methyl]amino]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[[amino(2,3-dihydroindol-1-ium-1-ylidene)methyl]amino]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[[amino(indolin-1-ium-1-ylidene)methyl]amino]-6-methyl-1H-pyrimidin-4-one Formula: C14H16N5O+ MolecularWeight: 270.30974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)NC(=[N+]2CCC3=CC=CC=C32)N

Isomeric SMILES

CC1=CC(=O)N=C(N1)NC(=[N+]2CCC3=CC=CC=C32)N

InChI

InChI=1S/C14H15N5O/c1-9-8-12(20)17-14(16-9)18-13(15)19-7-6-10-4-2-3-5-11(10)19/h2-5,8H,6-7H2,1H3,(H3,15,16,17,18,20)/p+1