3-[4-[5-[2-(dimethylaminomethyl)piperidin-1-yl]pentyl]-3-oxidanylidene-1,4-benzoxazin-2-yl]benzenecarboximidamide

Systemtic Name: 3-[4-[5-[2-(dimethylaminomethyl)piperidin-1-yl]pentyl]-3-oxidanylidene-1,4-benzoxazin-2-yl]benzenecarboximidamide Openeye Name: 3-[4-[5-[2-(dimethylaminomethyl)-1-piperidyl]pentyl]-3-oxo-1,4-benzoxazin-2-yl]benzamidine CAS Name: 3-[4-[5-[2-(dimethylaminomethyl)-1-piperidinyl]pentyl]-3-oxo-1,4-benzoxazin-2-yl]benzenecarboximidamide IUPAC Name: 3-[4-[5-[2-(dimethylaminomethyl)piperidin-1-yl]pentyl]-3-oxo-1,4-benzoxazin-2-yl]benzenecarboximidamide Traditional Name: 3-[4-[5-[2-(dimethylaminomethyl)piperidino]pentyl]-3-keto-1,4-benzoxazin-2-yl]benzamidine Formula: C28H39N5O2 MolecularWeight: 477.64156

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CCCCN1CCCCCN2C3=CC=CC=C3OC(C2=O)C4=CC=CC(=C4)C(=N)N

Isomeric SMILES

CN(C)CC1CCCCN1CCCCCN2C3=CC=CC=C3OC(C2=O)C4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C28H39N5O2/c1-31(2)20-23-13-6-9-17-32(23)16-7-3-8-18-33-24-14-4-5-15-25(24)35-26(28(33)34)21-11-10-12-22(19-21)27(29)30/h4-5,10-12,14-15,19,23,26H,3,6-9,13,16-18,20H2,1-2H3,(H3,29,30)