[4-[[2-cyanoethyl(4-piperidin-1-ylbutyl)amino]methyl]phenyl]methylcarbamic acid

Systemtic Name: [4-[[2-cyanoethyl(4-piperidin-1-ylbutyl)amino]methyl]phenyl]methylcarbamic acid Openeye Name: [4-[[2-cyanoethyl-[4-(1-piperidyl)butyl]amino]methyl]phenyl]methylcarbamic acid CAS Name: [4-[[2-cyanoethyl-[4-(1-piperidinyl)butyl]amino]methyl]phenyl]methylcarbamic acid IUPAC Name: [4-[[2-cyanoethyl(4-piperidin-1-ylbutyl)amino]methyl]phenyl]methylcarbamic acid Traditional Name: [4-[[2-cyanoethyl(4-piperidinobutyl)amino]methyl]benzyl]carbamic acid Formula: C21H32N4O2 MolecularWeight: 372.50438

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCCN(CCC#N)CC2=CC=C(C=C2)CNC(=O)O

Isomeric SMILES

C1CCN(CC1)CCCCN(CCC#N)CC2=CC=C(C=C2)CNC(=O)O

InChI

InChI=1S/C21H32N4O2/c22-11-6-16-25(15-5-4-14-24-12-2-1-3-13-24)18-20-9-7-19(8-10-20)17-23-21(26)27/h7-10,23H,1-6,12-18H2,(H,26,27)