2-[(2S,3S)-3-azanyl-4,4-diethoxy-2-[1-(phenylsulfonyl)indol-2-yl]piperidin-1-yl]ethanol

Systemtic Name: 2-[(2S,3S)-3-azanyl-4,4-diethoxy-2-[1-(phenylsulfonyl)indol-2-yl]piperidin-1-yl]ethanol Openeye Name: 2-[(2S,3S)-3-amino-2-[1-(benzenesulfonyl)indol-2-yl]-4,4-diethoxy-1-piperidyl]ethanol CAS Name: 2-[(2S,3S)-3-amino-2-[1-(benzenesulfonyl)-2-indolyl]-4,4-diethoxy-1-piperidinyl]ethanol IUPAC Name: 2-[(2S,3S)-3-amino-2-[1-(benzenesulfonyl)indol-2-yl]-4,4-diethoxypiperidin-1-yl]ethanol Traditional Name: 2-[(2S,3S)-3-amino-2-(1-besylindol-2-yl)-4,4-diethoxy-piperidino]ethanol Formula: C25H33N3O5S MolecularWeight: 487.61162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1(CCN(C(C1N)C2=CC3=CC=CC=C3N2S(=O)(=O)C4=CC=CC=C4)CCO)OCC

Isomeric SMILES

CCOC1(CCN([C@@H]([C@@H]1N)C2=CC3=CC=CC=C3N2S(=O)(=O)C4=CC=CC=C4)CCO)OCC

InChI

InChI=1S/C25H33N3O5S/c1-3-32-25(33-4-2)14-15-27(16-17-29)23(24(25)26)22-18-19-10-8-9-13-21(19)28(22)34(30,31)20-11-6-5-7-12-20/h5-13,18,23-24,29H,3-4,14-17,26H2,1-2H3/t23-,24+/m1/s1