3-ethyl-1-hexyl-3-methyl-spiro[indole-2,3'-pyrido[3,4-f][1,4]benzoxazine]

Systemtic Name: 3-ethyl-1-hexyl-3-methyl-spiro[indole-2,3'-pyrido[3,4-f][1,4]benzoxazine] Openeye Name: 3-ethyl-1-hexyl-3-methyl-spiro[indoline-2,3'-pyrido[3,4-f][1,4]benzoxazine] CAS Name: 3-ethyl-1-hexyl-3-methylspiro[indole-2,3'-pyrido[3,4-f][1,4]benzoxazine] IUPAC Name: 3-ethyl-1-hexyl-3-methylspiro[indole-2,3'-pyrido[3,4-f][1,4]benzoxazine] Traditional Name: 3-ethyl-1-hexyl-3-methyl-spiro[indoline-2,3'-pyrido[3,4-f][1,4]benzoxazine] Formula: C27H31N3O MolecularWeight: 413.55454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2C(C13C=NC4=C(O3)C=CC5=C4C=NC=C5)(C)CC

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2C(C13C=NC4=C(O3)C=CC5=C4C=NC=C5)(C)CC

InChI

InChI=1S/C27H31N3O/c1-4-6-7-10-17-30-23-12-9-8-11-22(23)26(3,5-2)27(30)19-29-25-21-18-28-16-15-20(21)13-14-24(25)31-27/h8-9,11-16,18-19H,4-7,10,17H2,1-3H3