2-[[1-(dipentylamino)-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]amino]ethanoic acid

Systemtic Name: 2-[[1-(dipentylamino)-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]amino]ethanoic acid Openeye Name: 2-[[2-(dipentylamino)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]amino]acetic acid CAS Name: 2-[[1-(dipentylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]acetic acid IUPAC Name: 2-[[1-(dipentylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]acetic acid Traditional Name: 2-[[2-(diamylamino)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]amino]acetic acid Formula: C23H35N3O3 MolecularWeight: 401.5423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C(=O)C(CC1=CNC2=CC=CC=C21)NCC(=O)O

Isomeric SMILES

CCCCCN(CCCCC)C(=O)C(CC1=CNC2=CC=CC=C21)NCC(=O)O

InChI

InChI=1S/C23H35N3O3/c1-3-5-9-13-26(14-10-6-4-2)23(29)21(25-17-22(27)28)15-18-16-24-20-12-8-7-11-19(18)20/h7-8,11-12,16,21,24-25H,3-6,9-10,13-15,17H2,1-2H3,(H,27,28)