2-[(2S)-3-[(5-chloranyl-1H-indol-2-yl)carbonylamino]-2-oxidanyl-3,4-dihydro-1H-naphthalen-2-yl]ethanoic acid

Systemtic Name: 2-[(2S)-3-[(5-chloranyl-1H-indol-2-yl)carbonylamino]-2-oxidanyl-3,4-dihydro-1H-naphthalen-2-yl]ethanoic acid Openeye Name: 2-[(2S)-3-[(5-chloro-1H-indole-2-carbonyl)amino]-2-hydroxy-tetralin-2-yl]acetic acid CAS Name: 2-[(2S)-3-[[(5-chloro-1H-indol-2-yl)-oxomethyl]amino]-2-hydroxy-3,4-dihydro-1H-naphthalen-2-yl]acetic acid IUPAC Name: 2-[(2S)-3-[(5-chloro-1H-indole-2-carbonyl)amino]-2-hydroxy-3,4-dihydro-1H-naphthalen-2-yl]acetic acid Traditional Name: 2-[(2S)-3-[(5-chloro-1H-indole-2-carbonyl)amino]-2-hydroxy-tetralin-2-yl]acetic acid Formula: C21H19ClN2O4 MolecularWeight: 398.83956

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CC2=CC=CC=C21)(CC(=O)O)O)NC(=O)C3=CC4=C(N3)C=CC(=C4)Cl

Isomeric SMILES

C1C([C@](CC2=CC=CC=C21)(CC(=O)O)O)NC(=O)C3=CC4=C(N3)C=CC(=C4)Cl

InChI

InChI=1S/C21H19ClN2O4/c22-15-5-6-16-14(7-15)8-17(23-16)20(27)24-18-9-12-3-1-2-4-13(12)10-21(18,28)11-19(25)26/h1-8,18,23,28H,9-11H2,(H,24,27)(H,25,26)/t18?,21-/m0/s1