3-[(9R)-9-ethyl-6-oxidanylidene-10-phenyldiazenyl-7,8-dihydropyrido[1,2-a]indol-9-yl]propyl methanesulfonate

Systemtic Name: 3-[(9R)-9-ethyl-6-oxidanylidene-10-phenyldiazenyl-7,8-dihydropyrido[1,2-a]indol-9-yl]propyl methanesulfonate Openeye Name: 3-[(9R)-9-ethyl-6-oxo-10-phenylazo-7,8-dihydropyrido[1,2-a]indol-9-yl]propyl methanesulfonate CAS Name: methanesulfonic acid 3-[(9R)-9-ethyl-6-oxo-10-phenyldiazenyl-7,8-dihydropyrido[1,2-a]indol-9-yl]propyl ester IUPAC Name: 3-[(9R)-9-ethyl-6-oxo-10-phenyldiazenyl-7,8-dihydropyrido[1,2-a]indol-9-yl]propyl methanesulfonate Traditional Name: methanesulfonic acid 3-[(9R)-9-ethyl-6-keto-10-phenylazo-7,8-dihydropyrid[1,2-a]indol-9-yl]propyl ester Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCC(=O)N2C1=C(C3=CC=CC=C32)N=NC4=CC=CC=C4)CCCOS(=O)(=O)C

Isomeric SMILES

CC[C@]1(CCC(=O)N2C1=C(C3=CC=CC=C32)N=NC4=CC=CC=C4)CCCOS(=O)(=O)C

InChI

InChI=1S/C24H27N3O4S/c1-3-24(15-9-17-31-32(2,29)30)16-14-21(28)27-20-13-8-7-12-19(20)22(23(24)27)26-25-18-10-5-4-6-11-18/h4-8,10-13H,3,9,14-17H2,1-2H3/t24-/m1/s1