(2S)-4-(1-ethylbenzotriazol-5-yl)carbonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2S)-4-(1-ethylbenzotriazol-5-yl)carbonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2S)-4-(1-ethylbenzotriazole-5-carbonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2S)-4-[(1-ethyl-5-benzotriazolyl)-oxomethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2S)-4-(1-ethylbenzotriazole-5-carbonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2S)-4-(1-ethylbenzotriazole-5-carbonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C18H17N5O3 MolecularWeight: 351.35928

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N3CC(OC4=CC=CC=C43)C(=O)N)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N3C[C@H](OC4=CC=CC=C43)C(=O)N)N=N1

InChI

InChI=1S/C18H17N5O3/c1-2-23-13-8-7-11(9-12(13)20-21-23)18(25)22-10-16(17(19)24)26-15-6-4-3-5-14(15)22/h3-9,16H,2,10H2,1H3,(H2,19,24)/t16-/m0/s1