3-[4-[4-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]-3-oxidanylidene-1,4-benzoxazin-2-yl]benzenecarboximidamide

Systemtic Name: 3-[4-[4-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]-3-oxidanylidene-1,4-benzoxazin-2-yl]benzenecarboximidamide Openeye Name: 3-[4-[4-[(2,6-dimethyl-1-piperidyl)methyl]phenyl]-3-oxo-1,4-benzoxazin-2-yl]benzamidine CAS Name: 3-[4-[4-[(2,6-dimethyl-1-piperidinyl)methyl]phenyl]-3-oxo-1,4-benzoxazin-2-yl]benzenecarboximidamide IUPAC Name: 3-[4-[4-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]-3-oxo-1,4-benzoxazin-2-yl]benzenecarboximidamide Traditional Name: 3-[4-[4-[(2,6-dimethylpiperidino)methyl]phenyl]-3-keto-1,4-benzoxazin-2-yl]benzamidine Formula: C29H32N4O2 MolecularWeight: 468.58998

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1CC2=CC=C(C=C2)N3C4=CC=CC=C4OC(C3=O)C5=CC=CC(=C5)C(=N)N)C

Isomeric SMILES

CC1CCCC(N1CC2=CC=C(C=C2)N3C4=CC=CC=C4OC(C3=O)C5=CC=CC(=C5)C(=N)N)C

InChI

InChI=1S/C29H32N4O2/c1-19-7-5-8-20(2)32(19)18-21-13-15-24(16-14-21)33-25-11-3-4-12-26(25)35-27(29(33)34)22-9-6-10-23(17-22)28(30)31/h3-4,6,9-17,19-20,27H,5,7-8,18H2,1-2H3,(H3,30,31)