N-[3-[[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide Openeye Name: N-[3-[[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]amino]-3-oxo-propyl]adamantane-1-carboxamide CAS Name: N-[3-[[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]amino]-3-oxopropyl]-1-adamantanecarboxamide IUPAC Name: N-[3-[[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]amino]-3-oxopropyl]adamantane-1-carboxamide Traditional Name: N-[3-keto-3-[[(2S)-3-keto-2-methyl-4H-1,4-benzoxazin-6-yl]amino]propyl]adamantane-1-carboxamide Formula: C23H29N3O4 MolecularWeight: 411.49406

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)CCNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C[C@H]1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)CCNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H29N3O4/c1-13-21(28)26-18-9-17(2-3-19(18)30-13)25-20(27)4-5-24-22(29)23-10-14-6-15(11-23)8-16(7-14)12-23/h2-3,9,13-16H,4-8,10-12H2,1H3,(H,24,29)(H,25,27)(H,26,28)/t13-,14?,15?,16?,23?/m0/s1