(5S,7R)-N-(1,3-benzodioxol-5-ylmethyl)-3-chloranyl-N-cyclopentyl-adamantane-1-carboxamide

Systemtic Name: (5S,7R)-N-(1,3-benzodioxol-5-ylmethyl)-3-chloranyl-N-cyclopentyl-adamantane-1-carboxamide Openeye Name: (5S,7R)-N-(1,3-benzodioxol-5-ylmethyl)-3-chloro-N-cyclopentyl-adamantane-1-carboxamide CAS Name: (5S,7R)-N-(1,3-benzodioxol-5-ylmethyl)-3-chloro-N-cyclopentyl-1-adamantanecarboxamide IUPAC Name: (5S,7R)-N-(1,3-benzodioxol-5-ylmethyl)-3-chloro-N-cyclopentyladamantane-1-carboxamide Traditional Name: (5S,7R)-3-chloro-N-cyclopentyl-N-piperonyl-adamantane-1-carboxamide Formula: C24H30ClNO3 MolecularWeight: 415.9529

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)C(=O)C45CC6CC(C4)CC(C6)(C5)Cl

Isomeric SMILES

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)C(=O)C45C[C@H]6C[C@@H](C4)CC(C6)(C5)Cl

InChI

InChI=1S/C24H30ClNO3/c25-24-11-17-7-18(12-24)10-23(9-17,14-24)22(27)26(19-3-1-2-4-19)13-16-5-6-20-21(8-16)29-15-28-20/h5-6,8,17-19H,1-4,7,9-15H2/t17-,18+,23?,24?