N-[2-[(2S)-2-ethyl-7-methoxy-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium-4-yl]ethyl]-4-oxidanylidene-chromene-2-carboxamide

Systemtic Name: N-[2-[(2S)-2-ethyl-7-methoxy-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium-4-yl]ethyl]-4-oxidanylidene-chromene-2-carboxamide Openeye Name: N-[2-[(2S)-2-ethyl-7-methoxy-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium-4-yl]ethyl]-4-oxo-chromene-2-carboxamide CAS Name: N-[2-[(2S)-2-ethyl-7-methoxy-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium-4-yl]ethyl]-4-oxo-1-benzopyran-2-carboxamide IUPAC Name: N-[2-[(2S)-2-ethyl-7-methoxy-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium-4-yl]ethyl]-4-oxochromene-2-carboxamide Traditional Name: N-[2-[(2S)-2-ethyl-7-methoxy-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium-4-yl]ethyl]-4-keto-chromene-2-carboxamide Formula: C24H27N2O5+ MolecularWeight: 423.48158

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C[NH+](CC2=C(O1)C=CC(=C2)OC)CCNC(=O)C3=CC(=O)C4=CC=CC=C4O3

Isomeric SMILES

CC[C@H]1C[NH+](CC2=C(O1)C=CC(=C2)OC)CCNC(=O)C3=CC(=O)C4=CC=CC=C4O3

InChI

InChI=1S/C24H26N2O5/c1-3-17-15-26(14-16-12-18(29-2)8-9-21(16)30-17)11-10-25-24(28)23-13-20(27)19-6-4-5-7-22(19)31-23/h4-9,12-13,17H,3,10-11,14-15H2,1-2H3,(H,25,28)/p+1/t17-/m0/s1