2-azanyl-2-(5-phenylmethoxycarbonyl-8-thia-6-azaspiro[3.4]octan-7-yl)ethanoic acid

Systemtic Name: 2-azanyl-2-(5-phenylmethoxycarbonyl-8-thia-6-azaspiro[3.4]octan-7-yl)ethanoic acid Openeye Name: 2-amino-2-(5-benzyloxycarbonyl-8-thia-6-azaspiro[3.4]octan-7-yl)acetic acid CAS Name: 2-amino-2-(5-phenylmethoxycarbonyl-8-thia-6-azaspiro[3.4]octan-7-yl)acetic acid IUPAC Name: 2-amino-2-(5-phenylmethoxycarbonyl-8-thia-6-azaspiro[3.4]octan-7-yl)acetic acid Traditional Name: 2-amino-2-(5-carbobenzoxy-8-thia-6-azaspiro[3.4]octan-7-yl)acetic acid Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(C1)C(NC(S2)C(C(=O)O)N)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CC2(C1)C(NC(S2)C(C(=O)O)N)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C16H20N2O4S/c17-11(14(19)20)13-18-12(16(23-13)7-4-8-16)15(21)22-9-10-5-2-1-3-6-10/h1-3,5-6,11-13,18H,4,7-9,17H2,(H,19,20)