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

Systemtic Name: N-[2-[(2S)-2-ethyl-7-methoxy-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium-4-yl]ethyl]-1-phenyl-cyclopropane-1-carboxamide Openeye Name: N-[2-[(2S)-2-ethyl-7-methoxy-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium-4-yl]ethyl]-1-phenyl-cyclopropanecarboxamide CAS Name: N-[2-[(2S)-2-ethyl-7-methoxy-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium-4-yl]ethyl]-1-phenyl-1-cyclopropanecarboxamide IUPAC Name: N-[2-[(2S)-2-ethyl-7-methoxy-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium-4-yl]ethyl]-1-phenylcyclopropane-1-carboxamide Traditional Name: N-[2-[(2S)-2-ethyl-7-methoxy-2,3,4,5-tetrahydro-1,4-benzoxazepin-4-ium-4-yl]ethyl]-1-phenyl-cyclopropanecarboxamide Formula: C24H31N2O3+ MolecularWeight: 395.51454

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C[NH+](CC2=C(O1)C=CC(=C2)OC)CCNC(=O)C3(CC3)C4=CC=CC=C4

Isomeric SMILES

CC[C@H]1C[NH+](CC2=C(O1)C=CC(=C2)OC)CCNC(=O)C3(CC3)C4=CC=CC=C4

InChI

InChI=1S/C24H30N2O3/c1-3-20-17-26(16-18-15-21(28-2)9-10-22(18)29-20)14-13-25-23(27)24(11-12-24)19-7-5-4-6-8-19/h4-10,15,20H,3,11-14,16-17H2,1-2H3,(H,25,27)/p+1/t20-/m0/s1