(3R)-2-[(1R,2S)-2-methylcyclopropyl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: (3R)-2-[(1R,2S)-2-methylcyclopropyl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: (3R)-2-[(1R,2S)-2-methylcyclopropanecarbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: (3R)-2-[[(1R,2S)-2-methylcyclopropyl]-oxomethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: (3R)-2-[(1R,2S)-2-methylcyclopropanecarbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: (3R)-2-[(1R,2S)-2-methylcyclopropanecarbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C15H17NO3 MolecularWeight: 259.30038

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C(=O)N2CC3=CC=CC=C3CC2C(=O)O

Isomeric SMILES

C[C@H]1C[C@H]1C(=O)N2CC3=CC=CC=C3C[C@@H]2C(=O)O

InChI

InChI=1S/C15H17NO3/c1-9-6-12(9)14(17)16-8-11-5-3-2-4-10(11)7-13(16)15(18)19/h2-5,9,12-13H,6-8H2,1H3,(H,18,19)/t9-,12+,13+/m0/s1