(2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(4-morpholin-4-ylphenyl)propanamide

Systemtic Name: (2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(4-morpholin-4-ylphenyl)propanamide Openeye Name: (2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(4-morpholinophenyl)propanamide CAS Name: (2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-[4-(4-morpholinyl)phenyl]propanamide IUPAC Name: (2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(4-morpholin-4-ylphenyl)propanamide Traditional Name: (2R)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(4-morpholinophenyl)propionamide Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCOCC2)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)N2CCOCC2)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C22H27N3O4/c1-16(23-18-5-8-20-21(15-18)29-12-2-11-28-20)22(26)24-17-3-6-19(7-4-17)25-9-13-27-14-10-25/h3-8,15-16,23H,2,9-14H2,1H3,(H,24,26)/t16-/m1/s1