N,N-diethyl-2-[4-(2-phenylindol-1-yl)phenoxy]ethanamine; 4-methylbenzenesulfonic acid

Systemtic Name: N,N-diethyl-2-[4-(2-phenylindol-1-yl)phenoxy]ethanamine; 4-methylbenzenesulfonic acid Openeye Name: N,N-diethyl-2-[4-(2-phenylindol-1-yl)phenoxy]ethanamine; 4-methylbenzenesulfonic acid CAS Name: N,N-diethyl-2-[4-(2-phenyl-1-indolyl)phenoxy]ethanamine; 4-methylbenzenesulfonic acid IUPAC Name: N,N-diethyl-2-[4-(2-phenylindol-1-yl)phenoxy]ethanamine; 4-methylbenzenesulfonic acid Traditional Name: diethyl-[2-[4-(2-phenylindol-1-yl)phenoxy]ethyl]amine; tosylic acid Formula: C33H36N2O4S MolecularWeight: 556.71494

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=CC=C(C=C1)N2C3=CC=CC=C3C=C2C4=CC=CC=C4.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCN(CC)CCOC1=CC=C(C=C1)N2C3=CC=CC=C3C=C2C4=CC=CC=C4.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C26H28N2O.C7H8O3S/c1-3-27(4-2)18-19-29-24-16-14-23(15-17-24)28-25-13-9-8-12-22(25)20-26(28)21-10-6-5-7-11-21;1-6-2-4-7(5-3-6)11(8,9)10/h5-17,20H,3-4,18-19H2,1-2H3;2-5H,1H3,(H,8,9,10)