5-[[3-[(2-aminocarbonyl-1-methyl-indol-5-yl)oxymethyl]phenyl]amino]-4-azanyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[3-[(2-aminocarbonyl-1-methyl-indol-5-yl)oxymethyl]phenyl]amino]-4-azanyl-5-oxidanylidene-pentanoic acid Openeye Name: 4-amino-5-[3-[(2-carbamoyl-1-methyl-indol-5-yl)oxymethyl]anilino]-5-oxo-pentanoic acid CAS Name: 4-amino-5-[3-[(2-carbamoyl-1-methyl-5-indolyl)oxymethyl]anilino]-5-oxopentanoic acid IUPAC Name: 4-amino-5-[3-[(2-carbamoyl-1-methylindol-5-yl)oxymethyl]anilino]-5-oxopentanoic acid Traditional Name: 4-amino-5-[3-[(2-carbamoyl-1-methyl-indol-5-yl)oxymethyl]anilino]-5-keto-valeric acid Formula: C22H24N4O5 MolecularWeight: 424.44976

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)OCC3=CC(=CC=C3)NC(=O)C(CCC(=O)O)N)C=C1C(=O)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)OCC3=CC(=CC=C3)NC(=O)C(CCC(=O)O)N)C=C1C(=O)N

InChI

InChI=1S/C22H24N4O5/c1-26-18-7-5-16(10-14(18)11-19(26)21(24)29)31-12-13-3-2-4-15(9-13)25-22(30)17(23)6-8-20(27)28/h2-5,7,9-11,17H,6,8,12,23H2,1H3,(H2,24,29)(H,25,30)(H,27,28)