N-[4-[[4-[(4-azanylcyclohexyl)methyl]cyclohexyl]carbamoyl]-2-methyl-phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-[[4-[(4-azanylcyclohexyl)methyl]cyclohexyl]carbamoyl]-2-methyl-phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]carbamoyl]-2-methyl-phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-[[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]amino]-oxomethyl]-2-methylphenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]carbamoyl]-2-methylphenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]carbamoyl]-2-methyl-phenyl]-piperonylamide Formula: C29H37N3O4 MolecularWeight: 491.62178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2CCC(CC2)CC3CCC(CC3)N)NC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2CCC(CC2)CC3CCC(CC3)N)NC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C29H37N3O4/c1-18-14-21(6-12-25(18)32-29(34)22-7-13-26-27(16-22)36-17-35-26)28(33)31-24-10-4-20(5-11-24)15-19-2-8-23(30)9-3-19/h6-7,12-14,16,19-20,23-24H,2-5,8-11,15,17,30H2,1H3,(H,31,33)(H,32,34)