(3S)-2-[(2S)-2-azanyl-3-phenyl-propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: (3S)-2-[(2S)-2-azanyl-3-phenyl-propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: (3S)-2-[(2S)-2-amino-3-phenyl-propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: (3S)-2-[(2S)-2-amino-1-oxo-3-phenylpropyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: (3S)-2-[(2S)-2-amino-3-phenylpropanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: (3S)-2-[(2S)-2-amino-3-phenyl-propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C19H20N2O3 MolecularWeight: 324.3737

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)C(=O)C(CC3=CC=CC=C3)N)C(=O)O

Isomeric SMILES

C1[C@H](N(CC2=CC=CC=C21)C(=O)[C@H](CC3=CC=CC=C3)N)C(=O)O

InChI

InChI=1S/C19H20N2O3/c20-16(10-13-6-2-1-3-7-13)18(22)21-12-15-9-5-4-8-14(15)11-17(21)19(23)24/h1-9,16-17H,10-12,20H2,(H,23,24)/t16-,17-/m0/s1