2-(2,6-dimethylhept-5-enyl)-9-prop-2-enyl-pyrimido[4,5-b]indole

Systemtic Name: 2-(2,6-dimethylhept-5-enyl)-9-prop-2-enyl-pyrimido[4,5-b]indole Openeye Name: 9-allyl-2-(2,6-dimethylhept-5-enyl)pyrimido[4,5-b]indole CAS Name: 2-(2,6-dimethylhept-5-enyl)-9-prop-2-enylpyrimido[4,5-b]indole IUPAC Name: 2-(2,6-dimethylhept-5-enyl)-9-prop-2-enylpyrimido[4,5-b]indole Traditional Name: 9-allyl-2-(2,6-dimethylhept-5-enyl)pyrimid[4,5-b]indole Formula: C22H27N3 MolecularWeight: 333.46988

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC=C(C)C)CC1=NC=C2C3=CC=CC=C3N(C2=N1)CC=C

Isomeric SMILES

CC(CCC=C(C)C)CC1=NC=C2C3=CC=CC=C3N(C2=N1)CC=C

InChI

InChI=1S/C22H27N3/c1-5-13-25-20-12-7-6-11-18(20)19-15-23-21(24-22(19)25)14-17(4)10-8-9-16(2)3/h5-7,9,11-12,15,17H,1,8,10,13-14H2,2-4H3