2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2,3-dihydro-1H-1-benzazepine-4-carboxylic acid

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2,3-dihydro-1H-1-benzazepine-4-carboxylic acid Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methyl]-2,3-dihydro-1H-1-benzazepine-4-carboxylic acid CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methyl]-2,3-dihydro-1H-1-benzazepine-4-carboxylic acid IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2,3-dihydro-1H-1-benzazepine-4-carboxylic acid Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methyl]-2,3-dihydro-1H-1-benzazepine-4-carboxylic acid Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CC2CC(=CC3=CC=CC=C3N2)C(=O)O

Isomeric SMILES

CC1=C(C(=NO1)C)CC2CC(=CC3=CC=CC=C3N2)C(=O)O

InChI

InChI=1S/C17H18N2O3/c1-10-15(11(2)22-19-10)9-14-8-13(17(20)21)7-12-5-3-4-6-16(12)18-14/h3-7,14,18H,8-9H2,1-2H3,(H,20,21)