2-[[2-[(1-ethoxy-1-oxidanylidene-propan-2-yl)amino]-3-methyl-butanoyl]-(1H-indol-5-yl)amino]ethanoic acid

Systemtic Name: 2-[[2-[(1-ethoxy-1-oxidanylidene-propan-2-yl)amino]-3-methyl-butanoyl]-(1H-indol-5-yl)amino]ethanoic acid Openeye Name: 2-[[2-[(2-ethoxy-1-methyl-2-oxo-ethyl)amino]-3-methyl-butanoyl]-(1H-indol-5-yl)amino]acetic acid CAS Name: 2-[[2-[(1-ethoxy-1-oxopropan-2-yl)amino]-3-methyl-1-oxobutyl]-(1H-indol-5-yl)amino]acetic acid IUPAC Name: 2-[[2-[(1-ethoxy-1-oxopropan-2-yl)amino]-3-methylbutanoyl]-(1H-indol-5-yl)amino]acetic acid Traditional Name: 2-[[2-[(2-ethoxy-2-keto-1-methyl-ethyl)amino]-3-methyl-butanoyl]-(1H-indol-5-yl)amino]acetic acid Formula: C20H27N3O5 MolecularWeight: 389.44548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)NC(C(C)C)C(=O)N(CC(=O)O)C1=CC2=C(C=C1)NC=C2

Isomeric SMILES

CCOC(=O)C(C)NC(C(C)C)C(=O)N(CC(=O)O)C1=CC2=C(C=C1)NC=C2

InChI

InChI=1S/C20H27N3O5/c1-5-28-20(27)13(4)22-18(12(2)3)19(26)23(11-17(24)25)15-6-7-16-14(10-15)8-9-21-16/h6-10,12-13,18,21-22H,5,11H2,1-4H3,(H,24,25)