N-(3,4-dihydro-2H-chromen-2-ylmethyl)-3-[3-(2-methylpropyl)phenyl]-3-methylsulfonyl-cyclopentan-1-amine

Systemtic Name: N-(3,4-dihydro-2H-chromen-2-ylmethyl)-3-[3-(2-methylpropyl)phenyl]-3-methylsulfonyl-cyclopentan-1-amine Openeye Name: N-(chroman-2-ylmethyl)-3-(3-isobutylphenyl)-3-methylsulfonyl-cyclopentanamine CAS Name: N-(3,4-dihydro-2H-1-benzopyran-2-ylmethyl)-3-[3-(2-methylpropyl)phenyl]-3-methylsulfonyl-1-cyclopentanamine IUPAC Name: N-(3,4-dihydro-2H-chromen-2-ylmethyl)-3-[3-(2-methylpropyl)phenyl]-3-methylsulfonylcyclopentan-1-amine Traditional Name: chroman-2-ylmethyl-[3-(3-isobutylphenyl)-3-mesyl-cyclopentyl]amine Formula: C26H35NO3S MolecularWeight: 441.626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=CC(=C1)C2(CCC(C2)NCC3CCC4=CC=CC=C4O3)S(=O)(=O)C

Isomeric SMILES

CC(C)CC1=CC=CC(=C1)C2(CCC(C2)NCC3CCC4=CC=CC=C4O3)S(=O)(=O)C

InChI

InChI=1S/C26H35NO3S/c1-19(2)15-20-7-6-9-22(16-20)26(31(3,28)29)14-13-23(17-26)27-18-24-12-11-21-8-4-5-10-25(21)30-24/h4-10,16,19,23-24,27H,11-15,17-18H2,1-3H3