N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-3-oxidanylidene-4H-1,4-benzoxazine-6-carboxamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-3-oxidanylidene-4H-1,4-benzoxazine-6-carboxamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-3-oxo-4H-1,4-benzoxazine-6-carboxamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-3-oxo-4H-1,4-benzoxazine-6-carboxamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-3-oxo-4H-1,4-benzoxazine-6-carboxamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-3-keto-4H-1,4-benzoxazine-6-carboxamide Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC4=C(C=C3)OCC(=O)N4

Isomeric SMILES

C[C@@H](C1=NC2=CC=CC=C2N1)NC(=O)C3=CC4=C(C=C3)OCC(=O)N4

InChI

InChI=1S/C18H16N4O3/c1-10(17-21-12-4-2-3-5-13(12)22-17)19-18(24)11-6-7-15-14(8-11)20-16(23)9-25-15/h2-8,10H,9H2,1H3,(H,19,24)(H,20,23)(H,21,22)/t10-/m0/s1