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

Systemtic Name: 4-azanyl-N-[1-[[1-(4-azanylbutyl)piperidin-4-yl]methyl]piperidin-4-yl]-5-chloranyl-2-methoxy-benzamide Openeye Name: 4-amino-N-[1-[[1-(4-aminobutyl)-4-piperidyl]methyl]-4-piperidyl]-5-chloro-2-methoxy-benzamide CAS Name: 4-amino-N-[1-[[1-(4-aminobutyl)-4-piperidinyl]methyl]-4-piperidinyl]-5-chloro-2-methoxybenzamide IUPAC Name: 4-amino-N-[1-[[1-(4-aminobutyl)piperidin-4-yl]methyl]piperidin-4-yl]-5-chloro-2-methoxybenzamide Traditional Name: 4-amino-N-[1-[[1-(4-aminobutyl)-4-piperidyl]methyl]-4-piperidyl]-5-chloro-2-methoxy-benzamide Formula: C23H38ClN5O2 MolecularWeight: 452.03312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H38ClN5O2/c1-31-22-15-21(26)20(24)14-19(22)23(30)27-18-6-12-29(13-7-18)16-17-4-10-28(11-5-17)9-3-2-8-25/h14-15,17-18H,2-13,16,25-26H2,1H3,(H,27,30)