3-[3-oxidanylidene-4-(5-pyrrolidin-1-ylpentyl)-1,4-benzoxazin-2-yl]benzenecarboximidamide

Systemtic Name: 3-[3-oxidanylidene-4-(5-pyrrolidin-1-ylpentyl)-1,4-benzoxazin-2-yl]benzenecarboximidamide Openeye Name: 3-[3-oxo-4-(5-pyrrolidin-1-ylpentyl)-1,4-benzoxazin-2-yl]benzamidine CAS Name: 3-[3-oxo-4-[5-(1-pyrrolidinyl)pentyl]-1,4-benzoxazin-2-yl]benzenecarboximidamide IUPAC Name: 3-[3-oxo-4-(5-pyrrolidin-1-ylpentyl)-1,4-benzoxazin-2-yl]benzenecarboximidamide Traditional Name: 3-[3-keto-4-(5-pyrrolidinopentyl)-1,4-benzoxazin-2-yl]benzamidine Formula: C24H30N4O2 MolecularWeight: 406.5206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCCCN2C3=CC=CC=C3OC(C2=O)C4=CC=CC(=C4)C(=N)N

Isomeric SMILES

C1CCN(C1)CCCCCN2C3=CC=CC=C3OC(C2=O)C4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C24H30N4O2/c25-23(26)19-10-8-9-18(17-19)22-24(29)28(20-11-2-3-12-21(20)30-22)16-5-1-4-13-27-14-6-7-15-27/h2-3,8-12,17,22H,1,4-7,13-16H2,(H3,25,26)