(2S)-N-(4-dimethylaminophenyl)-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanamide

Systemtic Name: (2S)-N-(4-dimethylaminophenyl)-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanamide Openeye Name: (2S)-N-(4-dimethylaminophenyl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide CAS Name: (2S)-N-(4-dimethylaminophenyl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide IUPAC Name: (2S)-N-(4-dimethylaminophenyl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide Traditional Name: (2S)-N-(4-dimethylaminophenyl)-2-(4-keto-1,2,3-benzotriazin-3-yl)propionamide Formula: C18H19N5O2 MolecularWeight: 337.37576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N(C)C)N2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)N(C)C)N2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C18H19N5O2/c1-12(17(24)19-13-8-10-14(11-9-13)22(2)3)23-18(25)15-6-4-5-7-16(15)20-21-23/h4-12H,1-3H3,(H,19,24)/t12-/m0/s1