4-[2-[(3R,4R)-3-ethenyl-1-heptyl-piperidin-4-yl]ethoxy]-6-methoxy-quinazoline

Systemtic Name: 4-[2-[(3R,4R)-3-ethenyl-1-heptyl-piperidin-4-yl]ethoxy]-6-methoxy-quinazoline Openeye Name: 4-[2-[(3R,4R)-1-heptyl-3-vinyl-4-piperidyl]ethoxy]-6-methoxy-quinazoline CAS Name: 4-[2-[(3R,4R)-3-ethenyl-1-heptyl-4-piperidinyl]ethoxy]-6-methoxyquinazoline IUPAC Name: 4-[2-[(3R,4R)-3-ethenyl-1-heptylpiperidin-4-yl]ethoxy]-6-methoxyquinazoline Traditional Name: 4-[2-[(3R,4R)-1-heptyl-3-vinyl-4-piperidyl]ethoxy]-6-methoxy-quinazoline Formula: C25H37N3O2 MolecularWeight: 411.58018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1CCC(C(C1)C=C)CCOC2=NC=NC3=C2C=C(C=C3)OC

Isomeric SMILES

CCCCCCCN1CC[C@@H]([C@H](C1)C=C)CCOC2=NC=NC3=C2C=C(C=C3)OC

InChI

InChI=1S/C25H37N3O2/c1-4-6-7-8-9-14-28-15-12-21(20(5-2)18-28)13-16-30-25-23-17-22(29-3)10-11-24(23)26-19-27-25/h5,10-11,17,19-21H,2,4,6-9,12-16,18H2,1,3H3/t20-,21+/m0/s1