3-phenethyl-1,4-dihydro-1,3,4-benzotriazepine-2,5-dione

Systemtic Name: 3-phenethyl-1,4-dihydro-1,3,4-benzotriazepine-2,5-dione Openeye Name: 3-phenethyl-1,4-dihydro-1,3,4-benzotriazepine-2,5-dione CAS Name: 3-phenethyl-1,4-dihydro-1,3,4-benzotriazepine-2,5-dione IUPAC Name: 3-phenethyl-1,4-dihydro-1,3,4-benzotriazepine-2,5-dione Traditional Name: 3-phenethyl-1,4-dihydro-1,3,4-benzotriazepine-2,5-quinone Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=O)NC3=CC=CC=C3C(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)NC3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C16H15N3O2/c20-15-13-8-4-5-9-14(13)17-16(21)19(18-15)11-10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,17,21)(H,18,20)