4-chloranyl-N-[4-[4-(3-cyanopropyl)-2-(methylaminomethyl)phenyl]cyclohexyl]-N-methyl-benzamide

Systemtic Name: 4-chloranyl-N-[4-[4-(3-cyanopropyl)-2-(methylaminomethyl)phenyl]cyclohexyl]-N-methyl-benzamide Openeye Name: 4-chloro-N-[4-[4-(3-cyanopropyl)-2-(methylaminomethyl)phenyl]cyclohexyl]-N-methyl-benzamide CAS Name: 4-chloro-N-[4-[4-(3-cyanopropyl)-2-(methylaminomethyl)phenyl]cyclohexyl]-N-methylbenzamide IUPAC Name: 4-chloro-N-[4-[4-(3-cyanopropyl)-2-(methylaminomethyl)phenyl]cyclohexyl]-N-methylbenzamide Traditional Name: 4-chloro-N-[4-[4-(3-cyanopropyl)-2-(methylaminomethyl)phenyl]cyclohexyl]-N-methyl-benzamide Formula: C26H32ClN3O MolecularWeight: 438.00478

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=C(C=CC(=C1)CCCC#N)C2CCC(CC2)N(C)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CNCC1=C(C=CC(=C1)CCCC#N)C2CCC(CC2)N(C)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C26H32ClN3O/c1-29-18-22-17-19(5-3-4-16-28)6-15-25(22)20-9-13-24(14-10-20)30(2)26(31)21-7-11-23(27)12-8-21/h6-8,11-12,15,17,20,24,29H,3-5,9-10,13-14,18H2,1-2H3