N,N-diethyl-2-[4-(5-methoxy-2-phenyl-indol-1-yl)phenoxy]ethanamine; 4-methylbenzenesulfonic acid

Systemtic Name: N,N-diethyl-2-[4-(5-methoxy-2-phenyl-indol-1-yl)phenoxy]ethanamine; 4-methylbenzenesulfonic acid Openeye Name: N,N-diethyl-2-[4-(5-methoxy-2-phenyl-indol-1-yl)phenoxy]ethanamine; 4-methylbenzenesulfonic acid CAS Name: N,N-diethyl-2-[4-(5-methoxy-2-phenyl-1-indolyl)phenoxy]ethanamine; 4-methylbenzenesulfonic acid IUPAC Name: N,N-diethyl-2-[4-(5-methoxy-2-phenylindol-1-yl)phenoxy]ethanamine; 4-methylbenzenesulfonic acid Traditional Name: diethyl-[2-[4-(5-methoxy-2-phenyl-indol-1-yl)phenoxy]ethyl]amine; tosylic acid Formula: C34H38N2O5S MolecularWeight: 586.74092

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=CC=C(C=C1)N2C3=C(C=C(C=C3)OC)C=C2C4=CC=CC=C4.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCN(CC)CCOC1=CC=C(C=C1)N2C3=C(C=C(C=C3)OC)C=C2C4=CC=CC=C4.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C27H30N2O2.C7H8O3S/c1-4-28(5-2)17-18-31-24-13-11-23(12-14-24)29-26-16-15-25(30-3)19-22(26)20-27(29)21-9-7-6-8-10-21;1-6-2-4-7(5-3-6)11(8,9)10/h6-16,19-20H,4-5,17-18H2,1-3H3;2-5H,1H3,(H,8,9,10)