4-azanyl-N-[1-[[1-(3-azanyl-2-oxidanyl-propyl)piperidin-4-yl]methyl]piperidin-4-yl]-5-chloranyl-2-methoxy-benzamide

Systemtic Name: 4-azanyl-N-[1-[[1-(3-azanyl-2-oxidanyl-propyl)piperidin-4-yl]methyl]piperidin-4-yl]-5-chloranyl-2-methoxy-benzamide Openeye Name: 4-amino-N-[1-[[1-(3-amino-2-hydroxy-propyl)-4-piperidyl]methyl]-4-piperidyl]-5-chloro-2-methoxy-benzamide CAS Name: 4-amino-N-[1-[[1-(3-amino-2-hydroxypropyl)-4-piperidinyl]methyl]-4-piperidinyl]-5-chloro-2-methoxybenzamide IUPAC Name: 4-amino-N-[1-[[1-(3-amino-2-hydroxypropyl)piperidin-4-yl]methyl]piperidin-4-yl]-5-chloro-2-methoxybenzamide Traditional Name: 4-amino-N-[1-[[1-(3-amino-2-hydroxy-propyl)-4-piperidyl]methyl]-4-piperidyl]-5-chloro-2-methoxy-benzamide Formula: C22H36ClN5O3 MolecularWeight: 454.00594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3CCN(CC3)CC(CN)O)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3CCN(CC3)CC(CN)O)Cl)N

InChI

InChI=1S/C22H36ClN5O3/c1-31-21-11-20(25)19(23)10-18(21)22(30)26-16-4-8-27(9-5-16)13-15-2-6-28(7-3-15)14-17(29)12-24/h10-11,15-17,29H,2-9,12-14,24-25H2,1H3,(H,26,30)