(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-pyren-1-yl-butanoic acid

Systemtic Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-pyren-1-yl-butanoic acid Openeye Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-pyren-1-yl-butanoic acid CAS Name: (2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-(1-pyrenyl)butanoic acid IUPAC Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-pyren-1-ylbutanoic acid Traditional Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-pyren-1-yl-butyric acid Formula: C35H27NO4 MolecularWeight: 525.59318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CCC4=C5C=CC6=CC=CC7=C6C5=C(C=C7)C=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CCC4=C5C=CC6=CC=CC7=C6C5=C(C=C7)C=C4)C(=O)O

InChI

InChI=1S/C35H27NO4/c37-34(38)31(36-35(39)40-20-30-28-10-3-1-8-26(28)27-9-2-4-11-29(27)30)19-17-21-12-13-24-15-14-22-6-5-7-23-16-18-25(21)33(24)32(22)23/h1-16,18,30-31H,17,19-20H2,(H,36,39)(H,37,38)/t31-/m0/s1