2-[2-[[(5-chloranyl-2-methoxy-4-methyl-phenyl)-pentyl-carbamoyl]-methyl-carbamoyl]indol-1-yl]ethanoic acid

Systemtic Name: 2-[2-[[(5-chloranyl-2-methoxy-4-methyl-phenyl)-pentyl-carbamoyl]-methyl-carbamoyl]indol-1-yl]ethanoic acid Openeye Name: 2-[2-[[(5-chloro-2-methoxy-4-methyl-phenyl)-pentyl-carbamoyl]-methyl-carbamoyl]indol-1-yl]acetic acid CAS Name: 2-[2-[[[(5-chloro-2-methoxy-4-methyl-N-pentylanilino)-oxomethyl]-methylamino]-oxomethyl]-1-indolyl]acetic acid IUPAC Name: 2-[2-[[(5-chloro-2-methoxy-4-methylphenyl)-pentylcarbamoyl]-methylcarbamoyl]indol-1-yl]acetic acid Traditional Name: 2-[2-[[amyl-(5-chloro-2-methoxy-4-methyl-phenyl)carbamoyl]-methyl-carbamoyl]indol-1-yl]acetic acid Formula: C26H30ClN3O5 MolecularWeight: 499.9865

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C1=C(C=C(C(=C1)Cl)C)OC)C(=O)N(C)C(=O)C2=CC3=CC=CC=C3N2CC(=O)O

Isomeric SMILES

CCCCCN(C1=C(C=C(C(=C1)Cl)C)OC)C(=O)N(C)C(=O)C2=CC3=CC=CC=C3N2CC(=O)O

InChI

InChI=1S/C26H30ClN3O5/c1-5-6-9-12-29(21-15-19(27)17(2)13-23(21)35-4)26(34)28(3)25(33)22-14-18-10-7-8-11-20(18)30(22)16-24(31)32/h7-8,10-11,13-15H,5-6,9,12,16H2,1-4H3,(H,31,32)