benzenesulfonic acid; 1-(1-pentylpiperidin-4-yl)indole

Systemtic Name: benzenesulfonic acid; 1-(1-pentylpiperidin-4-yl)indole Openeye Name: benzenesulfonic acid; 1-(1-pentyl-4-piperidyl)indole CAS Name: benzenesulfonic acid; 1-(1-pentyl-4-piperidinyl)indole IUPAC Name: benzenesulfonic acid; 1-(1-pentylpiperidin-4-yl)indole Traditional Name: 1-(1-amyl-4-piperidyl)indole; besylic acid Formula: C24H32N2O3S MolecularWeight: 428.58748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1CCC(CC1)N2C=CC3=CC=CC=C32.C1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCCCCN1CCC(CC1)N2C=CC3=CC=CC=C32.C1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C18H26N2.C6H6O3S/c1-2-3-6-12-19-13-10-17(11-14-19)20-15-9-16-7-4-5-8-18(16)20;7-10(8,9)6-4-2-1-3-5-6/h4-5,7-9,15,17H,2-3,6,10-14H2,1H3;1-5H,(H,7,8,9)