5-cyclohexyl-8-methyl-3-(phenylmethyl)-4H-1,3,4-benzotriazepin-2-one

Systemtic Name: 5-cyclohexyl-8-methyl-3-(phenylmethyl)-4H-1,3,4-benzotriazepin-2-one Openeye Name: 3-benzyl-5-cyclohexyl-8-methyl-4H-1,3,4-benzotriazepin-2-one CAS Name: 5-cyclohexyl-8-methyl-3-(phenylmethyl)-4H-1,3,4-benzotriazepin-2-one IUPAC Name: 3-benzyl-5-cyclohexyl-8-methyl-4H-1,3,4-benzotriazepin-2-one Traditional Name: 3-benzyl-5-cyclohexyl-8-methyl-4H-1,3,4-benzotriazepin-2-one Formula: C22H25N3O MolecularWeight: 347.4534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=O)N(NC(=C2C=C1)C3CCCCC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=NC(=O)N(NC(=C2C=C1)C3CCCCC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H25N3O/c1-16-12-13-19-20(14-16)23-22(26)25(15-17-8-4-2-5-9-17)24-21(19)18-10-6-3-7-11-18/h2,4-5,8-9,12-14,18,24H,3,6-7,10-11,15H2,1H3