5-cyclohexyl-8-methyl-3-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-7-yl)-4H-1,3,4-benzotriazepin-2-one

Systemtic Name: 5-cyclohexyl-8-methyl-3-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-7-yl)-4H-1,3,4-benzotriazepin-2-one Openeye Name: 5-cyclohexyl-8-methyl-3-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-7-yl)-4H-1,3,4-benzotriazepin-2-one CAS Name: 5-cyclohexyl-8-methyl-3-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-7-yl)-4H-1,3,4-benzotriazepin-2-one IUPAC Name: 5-cyclohexyl-8-methyl-3-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-7-yl)-4H-1,3,4-benzotriazepin-2-one Traditional Name: 5-cyclohexyl-8-methyl-3-(6,7,8,9-tetrahydro-5H-benzocyclohepten-7-yl)-4H-1,3,4-benzotriazepin-2-one Formula: C26H31N3O MolecularWeight: 401.54384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=O)N(NC(=C2C=C1)C3CCCCC3)C4CCC5=CC=CC=C5CC4

Isomeric SMILES

CC1=CC2=NC(=O)N(NC(=C2C=C1)C3CCCCC3)C4CCC5=CC=CC=C5CC4

InChI

InChI=1S/C26H31N3O/c1-18-11-16-23-24(17-18)27-26(30)29(28-25(23)21-9-3-2-4-10-21)22-14-12-19-7-5-6-8-20(19)13-15-22/h5-8,11,16-17,21-22,28H,2-4,9-10,12-15H2,1H3