4-azanyl-5-chloranyl-N-[1-(1,3-dioxolan-2-ylmethyl)piperidin-4-yl]-2-hexoxy-benzamide; iodanylmethane

Systemtic Name: 4-azanyl-5-chloranyl-N-[1-(1,3-dioxolan-2-ylmethyl)piperidin-4-yl]-2-hexoxy-benzamide; iodanylmethane Openeye Name: 4-amino-5-chloro-N-[1-(1,3-dioxolan-2-ylmethyl)-4-piperidyl]-2-hexoxy-benzamide; iodomethane CAS Name: 4-amino-5-chloro-N-[1-(1,3-dioxolan-2-ylmethyl)-4-piperidinyl]-2-hexoxybenzamide; iodomethane IUPAC Name: 4-amino-5-chloro-N-[1-(1,3-dioxolan-2-ylmethyl)piperidin-4-yl]-2-hexoxybenzamide; iodomethane Traditional Name: 4-amino-5-chloro-N-[1-(1,3-dioxolan-2-ylmethyl)-4-piperidyl]-2-hexoxy-benzamide; iodomethane Formula: C23H37ClIN3O4 MolecularWeight: 581.91505

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3OCCO3)Cl)N.CI

Isomeric SMILES

CCCCCCOC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3OCCO3)Cl)N.CI

InChI

InChI=1S/C22H34ClN3O4.CH3I/c1-2-3-4-5-10-28-20-14-19(24)18(23)13-17(20)22(27)25-16-6-8-26(9-7-16)15-21-29-11-12-30-21;1-2/h13-14,16,21H,2-12,15,24H2,1H3,(H,25,27);1H3