3-[2-(1,3-dioxan-2-yl)ethyl]-4-[(phenylmethyl)amino]cyclobutane-1,2-dione

Systemtic Name: 3-[2-(1,3-dioxan-2-yl)ethyl]-4-[(phenylmethyl)amino]cyclobutane-1,2-dione Openeye Name: 3-(benzylamino)-4-[2-(1,3-dioxan-2-yl)ethyl]cyclobutane-1,2-dione CAS Name: 3-[2-(1,3-dioxan-2-yl)ethyl]-4-[(phenylmethyl)amino]cyclobutane-1,2-dione IUPAC Name: 3-(benzylamino)-4-[2-(1,3-dioxan-2-yl)ethyl]cyclobutane-1,2-dione Traditional Name: 3-(benzylamino)-4-[2-(1,3-dioxan-2-yl)ethyl]cyclobutane-1,2-quinone Formula: C17H21NO4 MolecularWeight: 303.35294

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(OC1)CCC2C(C(=O)C2=O)NCC3=CC=CC=C3

Isomeric SMILES

C1COC(OC1)CCC2C(C(=O)C2=O)NCC3=CC=CC=C3

InChI

InChI=1S/C17H21NO4/c19-16-13(7-8-14-21-9-4-10-22-14)15(17(16)20)18-11-12-5-2-1-3-6-12/h1-3,5-6,13-15,18H,4,7-11H2