3-[2-(1H-indol-2-ylmethyl)pentanoylamino]-4-(methylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[2-(1H-indol-2-ylmethyl)pentanoylamino]-4-(methylamino)-4-oxidanylidene-butanoic acid Openeye Name: 3-[2-(1H-indol-2-ylmethyl)pentanoylamino]-4-(methylamino)-4-oxo-butanoic acid CAS Name: 3-[[2-(1H-indol-2-ylmethyl)-1-oxopentyl]amino]-4-(methylamino)-4-oxobutanoic acid IUPAC Name: 3-[2-(1H-indol-2-ylmethyl)pentanoylamino]-4-(methylamino)-4-oxobutanoic acid Traditional Name: 3-[2-(1H-indol-2-ylmethyl)pentanoylamino]-4-keto-4-(methylamino)butyric acid Formula: C19H25N3O4 MolecularWeight: 359.4195

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1=CC2=CC=CC=C2N1)C(=O)NC(CC(=O)O)C(=O)NC

Isomeric SMILES

CCCC(CC1=CC2=CC=CC=C2N1)C(=O)NC(CC(=O)O)C(=O)NC

InChI

InChI=1S/C19H25N3O4/c1-3-6-13(10-14-9-12-7-4-5-8-15(12)21-14)18(25)22-16(11-17(23)24)19(26)20-2/h4-5,7-9,13,16,21H,3,6,10-11H2,1-2H3,(H,20,26)(H,22,25)(H,23,24)