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

Systemtic Name: 4-azanyl-N-[[1-[(1-but-2-ynoylpiperidin-4-yl)methyl]piperidin-4-yl]methyl]-5-chloranyl-2-methoxy-benzamide Openeye Name: 4-amino-N-[[1-[(1-but-2-ynoyl-4-piperidyl)methyl]-4-piperidyl]methyl]-5-chloro-2-methoxy-benzamide CAS Name: 4-amino-5-chloro-2-methoxy-N-[[1-[[1-(1-oxobut-2-ynyl)-4-piperidinyl]methyl]-4-piperidinyl]methyl]benzamide IUPAC Name: 4-amino-N-[[1-[(1-but-2-ynoylpiperidin-4-yl)methyl]piperidin-4-yl]methyl]-5-chloro-2-methoxybenzamide Traditional Name: 4-amino-N-[[1-[(1-but-2-ynoyl-4-piperidyl)methyl]-4-piperidyl]methyl]-5-chloro-2-methoxy-benzamide Formula: C24H33ClN4O3 MolecularWeight: 460.99682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC#CC(=O)N1CCC(CC1)CN2CCC(CC2)CNC(=O)C3=CC(=C(C=C3OC)N)Cl

Isomeric SMILES

CC#CC(=O)N1CCC(CC1)CN2CCC(CC2)CNC(=O)C3=CC(=C(C=C3OC)N)Cl

InChI

InChI=1S/C24H33ClN4O3/c1-3-4-23(30)29-11-7-18(8-12-29)16-28-9-5-17(6-10-28)15-27-24(31)19-13-20(25)21(26)14-22(19)32-2/h13-14,17-18H,5-12,15-16,26H2,1-2H3,(H,27,31)