2-[2-(2-azanyl-4-oxidanylidene-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-6-yl)ethyl]benzaldehyde

Systemtic Name: 2-[2-(2-azanyl-4-oxidanylidene-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-6-yl)ethyl]benzaldehyde Openeye Name: 2-[2-(2-amino-4-oxo-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-6-yl)ethyl]benzaldehyde CAS Name: 2-[2-(2-amino-4-oxo-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-6-yl)ethyl]benzaldehyde IUPAC Name: 2-[2-(2-amino-4-oxo-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-6-yl)ethyl]benzaldehyde Traditional Name: 2-[2-(2-amino-4-keto-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-6-yl)ethyl]benzaldehyde Formula: C16H17N3O2 MolecularWeight: 283.32508

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC2=C1C(=O)N=C(N2)N)CCC3=CC=CC=C3C=O

Isomeric SMILES

C1C(CC2=C1C(=O)N=C(N2)N)CCC3=CC=CC=C3C=O

InChI

InChI=1S/C16H17N3O2/c17-16-18-14-8-10(7-13(14)15(21)19-16)5-6-11-3-1-2-4-12(11)9-20/h1-4,9-10H,5-8H2,(H3,17,18,19,21)