1-[4-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]piperidin-1-yl]-4-methyl-pentan-1-one

Systemtic Name: 1-[4-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]piperidin-1-yl]-4-methyl-pentan-1-one Openeye Name: 1-[4-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]-1-piperidyl]-4-methyl-pentan-1-one CAS Name: 1-[4-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]-1-piperidinyl]-4-methyl-1-pentanone IUPAC Name: 1-[4-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]piperidin-1-yl]-4-methylpentan-1-one Traditional Name: 1-[4-[4-(2-imidazolin-2-ylamino)benzyl]piperidino]-4-methyl-pentan-1-one Formula: C21H32N4O MolecularWeight: 356.50498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)N1CCC(CC1)CC2=CC=C(C=C2)NC3=NCCN3

Isomeric SMILES

CC(C)CCC(=O)N1CCC(CC1)CC2=CC=C(C=C2)NC3=NCCN3

InChI

InChI=1S/C21H32N4O/c1-16(2)3-8-20(26)25-13-9-18(10-14-25)15-17-4-6-19(7-5-17)24-21-22-11-12-23-21/h4-7,16,18H,3,8-15H2,1-2H3,(H2,22,23,24)