(3R)-N-(1H-imidazol-2-ylmethyl)-N-[(1S)-1-phenylethyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3R)-N-(1H-imidazol-2-ylmethyl)-N-[(1S)-1-phenylethyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3R)-N-(1H-imidazol-2-ylmethyl)-N-[(1S)-1-phenylethyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3R)-N-(1H-imidazol-2-ylmethyl)-N-[(1S)-1-phenylethyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3R)-N-(1H-imidazol-2-ylmethyl)-N-[(1S)-1-phenylethyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3R)-N-(1H-imidazol-2-ylmethyl)-N-[(1S)-1-phenylethyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(CC2=NC=CN2)C(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)N(CC2=NC=CN2)C(=O)[C@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C21H21N3O3/c1-15(16-7-3-2-4-8-16)24(13-20-22-11-12-23-20)21(25)19-14-26-17-9-5-6-10-18(17)27-19/h2-12,15,19H,13-14H2,1H3,(H,22,23)/t15-,19+/m0/s1