3-[2-azanyl-3-[1-(phenylmethyl)indol-3-yl]propanoyl]oxycarbonyl-1,2,2-trimethyl-cyclopentane-1-carboxylic acid

Systemtic Name: 3-[2-azanyl-3-[1-(phenylmethyl)indol-3-yl]propanoyl]oxycarbonyl-1,2,2-trimethyl-cyclopentane-1-carboxylic acid Openeye Name: 3-[2-amino-3-(1-benzylindol-3-yl)propanoyl]oxycarbonyl-1,2,2-trimethyl-cyclopentanecarboxylic acid CAS Name: 3-[[2-amino-1-oxo-3-[1-(phenylmethyl)-3-indolyl]propoxy]-oxomethyl]-1,2,2-trimethyl-1-cyclopentanecarboxylic acid IUPAC Name: 3-[2-amino-3-(1-benzylindol-3-yl)propanoyl]oxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylic acid Traditional Name: 3-[2-amino-3-(1-benzylindol-3-yl)propanoyl]oxycarbonyl-1,2,2-trimethyl-cyclopentanecarboxylic acid Formula: C28H32N2O5 MolecularWeight: 476.56408

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC1(C)C(=O)O)C(=O)OC(=O)C(CC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)N)C

Isomeric SMILES

CC1(C(CCC1(C)C(=O)O)C(=O)OC(=O)C(CC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)N)C

InChI

InChI=1S/C28H32N2O5/c1-27(2)21(13-14-28(27,3)26(33)34)24(31)35-25(32)22(29)15-19-17-30(16-18-9-5-4-6-10-18)23-12-8-7-11-20(19)23/h4-12,17,21-22H,13-16,29H2,1-3H3,(H,33,34)