N-methyl-1-[(2S)-7-(phenylsulfonyl)-3,4-dihydro-2H-chromen-2-yl]methanamine

Systemtic Name: N-methyl-1-[(2S)-7-(phenylsulfonyl)-3,4-dihydro-2H-chromen-2-yl]methanamine Openeye Name: 1-[(2S)-7-(benzenesulfonyl)chroman-2-yl]-N-methyl-methanamine CAS Name: 1-[(2S)-7-(benzenesulfonyl)-3,4-dihydro-2H-1-benzopyran-2-yl]-N-methylmethanamine IUPAC Name: 1-[(2S)-7-(benzenesulfonyl)-3,4-dihydro-2H-chromen-2-yl]-N-methylmethanamine Traditional Name: [(2S)-7-besylchroman-2-yl]methyl-methyl-amine Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1CCC2=C(O1)C=C(C=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CNC[C@@H]1CCC2=C(O1)C=C(C=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H19NO3S/c1-18-12-14-9-7-13-8-10-16(11-17(13)21-14)22(19,20)15-5-3-2-4-6-15/h2-6,8,10-11,14,18H,7,9,12H2,1H3/t14-/m0/s1