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

Systemtic Name: 4-azanyl-5-chloranyl-N-[1-[(1-hex-2-ynoylpiperidin-4-yl)methyl]piperidin-4-yl]-2-methoxy-benzamide Openeye Name: 4-amino-5-chloro-N-[1-[(1-hex-2-ynoyl-4-piperidyl)methyl]-4-piperidyl]-2-methoxy-benzamide CAS Name: 4-amino-5-chloro-2-methoxy-N-[1-[[1-(1-oxohex-2-ynyl)-4-piperidinyl]methyl]-4-piperidinyl]benzamide IUPAC Name: 4-amino-5-chloro-N-[1-[(1-hex-2-ynoylpiperidin-4-yl)methyl]piperidin-4-yl]-2-methoxybenzamide Traditional Name: 4-amino-5-chloro-N-[1-[(1-hex-2-ynoyl-4-piperidyl)methyl]-4-piperidyl]-2-methoxy-benzamide Formula: C25H35ClN4O3 MolecularWeight: 475.0234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35ClN4O3/c1-3-4-5-6-24(31)30-13-7-18(8-14-30)17-29-11-9-19(10-12-29)28-25(32)20-15-21(26)22(27)16-23(20)33-2/h15-16,18-19H,3-4,7-14,17,27H2,1-2H3,(H,28,32)