3-[(2-methylimidazol-1-yl)methyl]-9-oct-2-ynyl-2,3-dihydro-1H-carbazol-4-one

Systemtic Name: 3-[(2-methylimidazol-1-yl)methyl]-9-oct-2-ynyl-2,3-dihydro-1H-carbazol-4-one Openeye Name: 3-[(2-methylimidazol-1-yl)methyl]-9-oct-2-ynyl-2,3-dihydro-1H-carbazol-4-one CAS Name: 3-[(2-methyl-1-imidazolyl)methyl]-9-oct-2-ynyl-2,3-dihydro-1H-carbazol-4-one IUPAC Name: 3-[(2-methylimidazol-1-yl)methyl]-9-oct-2-ynyl-2,3-dihydro-1H-carbazol-4-one Traditional Name: 3-[(2-methylimidazol-1-yl)methyl]-9-oct-2-ynyl-2,3-dihydro-1H-carbazol-4-one Formula: C25H29N3O MolecularWeight: 387.51726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CCN1C2=C(C3=CC=CC=C31)C(=O)C(CC2)CN4C=CN=C4C

Isomeric SMILES

CCCCCC#CCN1C2=C(C3=CC=CC=C31)C(=O)C(CC2)CN4C=CN=C4C

InChI

InChI=1S/C25H29N3O/c1-3-4-5-6-7-10-16-28-22-12-9-8-11-21(22)24-23(28)14-13-20(25(24)29)18-27-17-15-26-19(27)2/h8-9,11-12,15,17,20H,3-6,13-14,16,18H2,1-2H3