2-[(1-phenylethylamino)methyl]-N-phenylsulfanylperoxy-3,4-dihydro-2H-chromen-7-amine

Systemtic Name: 2-[(1-phenylethylamino)methyl]-N-phenylsulfanylperoxy-3,4-dihydro-2H-chromen-7-amine Openeye Name: 2-[(1-phenylethylamino)methyl]-N-phenylsulfanylperoxy-chroman-7-amine CAS Name: benzenesulfenic acid [[2-[(1-phenylethylamino)methyl]-3,4-dihydro-2H-1-benzopyran-7-yl]amino]oxy ester IUPAC Name: 2-[(1-phenylethylamino)methyl]-N-phenylsulfanylperoxy-3,4-dihydro-2H-chromen-7-amine Traditional Name: 1-phenylethyl-[[7-[(phenylthio)peroxyamino]chroman-2-yl]methyl]amine Formula: C24H26N2O3S MolecularWeight: 422.53984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NCC2CCC3=C(O2)C=C(C=C3)NOOSC4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=CC=C1)NCC2CCC3=C(O2)C=C(C=C3)NOOSC4=CC=CC=C4

InChI

InChI=1S/C24H26N2O3S/c1-18(19-8-4-2-5-9-19)25-17-22-15-13-20-12-14-21(16-24(20)27-22)26-28-29-30-23-10-6-3-7-11-23/h2-12,14,16,18,22,25-26H,13,15,17H2,1H3