2-azanyl-N-[2-[[1-[(4-ethylphenyl)methyl]piperidin-4-yl]methylamino]-2-oxidanylidene-ethyl]-5-iodanyl-benzamide

Systemtic Name: 2-azanyl-N-[2-[[1-[(4-ethylphenyl)methyl]piperidin-4-yl]methylamino]-2-oxidanylidene-ethyl]-5-iodanyl-benzamide Openeye Name: 2-amino-N-[2-[[1-[(4-ethylphenyl)methyl]-4-piperidyl]methylamino]-2-oxo-ethyl]-5-iodo-benzamide CAS Name: 2-amino-N-[2-[[1-[(4-ethylphenyl)methyl]-4-piperidinyl]methylamino]-2-oxoethyl]-5-iodobenzamide IUPAC Name: 2-amino-N-[2-[[1-[(4-ethylphenyl)methyl]piperidin-4-yl]methylamino]-2-oxoethyl]-5-iodobenzamide Traditional Name: 2-amino-N-[2-[[1-(4-ethylbenzyl)-4-piperidyl]methylamino]-2-keto-ethyl]-5-iodo-benzamide Formula: C24H31IN4O2 MolecularWeight: 534.43301

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2CCC(CC2)CNC(=O)CNC(=O)C3=C(C=CC(=C3)I)N

Isomeric SMILES

CCC1=CC=C(C=C1)CN2CCC(CC2)CNC(=O)CNC(=O)C3=C(C=CC(=C3)I)N

InChI

InChI=1S/C24H31IN4O2/c1-2-17-3-5-19(6-4-17)16-29-11-9-18(10-12-29)14-27-23(30)15-28-24(31)21-13-20(25)7-8-22(21)26/h3-8,13,18H,2,9-12,14-16,26H2,1H3,(H,27,30)(H,28,31)