1-heptyl-3,3-dimethyl-spiro[indole-2,3'-pyrido[3,4-f][1,4]benzoxazine]

Systemtic Name: 1-heptyl-3,3-dimethyl-spiro[indole-2,3'-pyrido[3,4-f][1,4]benzoxazine] Openeye Name: 1-heptyl-3,3-dimethyl-spiro[indoline-2,3'-pyrido[3,4-f][1,4]benzoxazine] CAS Name: 1-heptyl-3,3-dimethylspiro[indole-2,3'-pyrido[3,4-f][1,4]benzoxazine] IUPAC Name: 1-heptyl-3,3-dimethylspiro[indole-2,3'-pyrido[3,4-f][1,4]benzoxazine] Traditional Name: 1-heptyl-3,3-dimethyl-spiro[indoline-2,3'-pyrido[3,4-f][1,4]benzoxazine] Formula: C27H31N3O MolecularWeight: 413.55454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C2=CC=CC=C2C(C13C=NC4=C(O3)C=CC5=C4C=NC=C5)(C)C

Isomeric SMILES

CCCCCCCN1C2=CC=CC=C2C(C13C=NC4=C(O3)C=CC5=C4C=NC=C5)(C)C

InChI

InChI=1S/C27H31N3O/c1-4-5-6-7-10-17-30-23-12-9-8-11-22(23)26(2,3)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