(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(2-methoxy-5-methyl-phenyl)-2-phenyl-ethanamide

Systemtic Name: (2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(2-methoxy-5-methyl-phenyl)-2-phenyl-ethanamide Openeye Name: (2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(2-methoxy-5-methyl-phenyl)-2-phenyl-acetamide CAS Name: (2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(2-methoxy-5-methylphenyl)-2-phenylacetamide IUPAC Name: (2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(2-methoxy-5-methylphenyl)-2-phenylacetamide Traditional Name: (2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(2-methoxy-5-methyl-phenyl)-2-phenyl-acetamide Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(C2=CC=CC=C2)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)[C@H](C2=CC=CC=C2)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C25H26N2O4/c1-17-9-11-21(29-2)20(15-17)27-25(28)24(18-7-4-3-5-8-18)26-19-10-12-22-23(16-19)31-14-6-13-30-22/h3-5,7-12,15-16,24,26H,6,13-14H2,1-2H3,(H,27,28)/t24-/m0/s1