7-phenylmethoxy-4-[2-(1-phenylpentan-2-ylamino)ethanoyl]-1H-indole-2-carboxylic acid

Systemtic Name: 7-phenylmethoxy-4-[2-(1-phenylpentan-2-ylamino)ethanoyl]-1H-indole-2-carboxylic acid Openeye Name: 4-[2-(1-benzylbutylamino)acetyl]-7-benzyloxy-1H-indole-2-carboxylic acid CAS Name: 4-[1-oxo-2-(1-phenylpentan-2-ylamino)ethyl]-7-phenylmethoxy-1H-indole-2-carboxylic acid IUPAC Name: 7-phenylmethoxy-4-[2-(1-phenylpentan-2-ylamino)acetyl]-1H-indole-2-carboxylic acid Traditional Name: 7-benzoxy-4-[2-(1-benzylbutylamino)acetyl]-1H-indole-2-carboxylic acid Formula: C29H30N2O4 MolecularWeight: 470.5595

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1=CC=CC=C1)NCC(=O)C2=C3C=C(NC3=C(C=C2)OCC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CCCC(CC1=CC=CC=C1)NCC(=O)C2=C3C=C(NC3=C(C=C2)OCC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C29H30N2O4/c1-2-9-22(16-20-10-5-3-6-11-20)30-18-26(32)23-14-15-27(35-19-21-12-7-4-8-13-21)28-24(23)17-25(31-28)29(33)34/h3-8,10-15,17,22,30-31H,2,9,16,18-19H2,1H3,(H,33,34)