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

Systemtic Name: 4-azanyl-N-[1-[[1-(3-azanylpropanoyl)piperidin-4-yl]methyl]piperidin-4-yl]-5-chloranyl-2-methoxy-benzamide Openeye Name: 4-amino-N-[1-[[1-(3-aminopropanoyl)-4-piperidyl]methyl]-4-piperidyl]-5-chloro-2-methoxy-benzamide CAS Name: 4-amino-N-[1-[[1-(3-amino-1-oxopropyl)-4-piperidinyl]methyl]-4-piperidinyl]-5-chloro-2-methoxybenzamide IUPAC Name: 4-amino-N-[1-[[1-(3-aminopropanoyl)piperidin-4-yl]methyl]piperidin-4-yl]-5-chloro-2-methoxybenzamide Traditional Name: 4-amino-N-[1-[[1-(3-aminopropanoyl)-4-piperidyl]methyl]-4-piperidyl]-5-chloro-2-methoxy-benzamide Formula: C22H34ClN5O3 MolecularWeight: 451.99006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H34ClN5O3/c1-31-20-13-19(25)18(23)12-17(20)22(30)26-16-5-8-27(9-6-16)14-15-3-10-28(11-4-15)21(29)2-7-24/h12-13,15-16H,2-11,14,24-25H2,1H3,(H,26,30)