[(2S)-4-(1-ethylbenzotriazol-5-yl)carbonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-yl-methanone

Systemtic Name: [(2S)-4-(1-ethylbenzotriazol-5-yl)carbonyl-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-yl-methanone Openeye Name: [(2S)-4-(1-ethylbenzotriazole-5-carbonyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-(1-piperidyl)methanone CAS Name: [(2S)-4-[(1-ethyl-5-benzotriazolyl)-oxomethyl]-2,3-dihydro-1,4-benzoxazin-2-yl]-(1-piperidinyl)methanone IUPAC Name: [(2S)-4-(1-ethylbenzotriazole-5-carbonyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-ylmethanone Traditional Name: [(2S)-4-(1-ethylbenzotriazole-5-carbonyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidino-methanone Formula: C23H25N5O3 MolecularWeight: 419.4763

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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)N5CCCCC5)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N3C[C@H](OC4=CC=CC=C43)C(=O)N5CCCCC5)N=N1

InChI

InChI=1S/C23H25N5O3/c1-2-28-18-11-10-16(14-17(18)24-25-28)22(29)27-15-21(23(30)26-12-6-3-7-13-26)31-20-9-5-4-8-19(20)27/h4-5,8-11,14,21H,2-3,6-7,12-13,15H2,1H3/t21-/m0/s1