2-ethyl-6-methyl-4-(octylcarbamoyl)-7-oxidanylidene-7-(propan-2-ylamino)heptanoic acid

Systemtic Name: 2-ethyl-6-methyl-4-(octylcarbamoyl)-7-oxidanylidene-7-(propan-2-ylamino)heptanoic acid Openeye Name: 2-ethyl-7-(isopropylamino)-6-methyl-4-(octylcarbamoyl)-7-oxo-heptanoic acid CAS Name: 2-ethyl-6-methyl-4-[(octylamino)-oxomethyl]-7-oxo-7-(propan-2-ylamino)heptanoic acid IUPAC Name: 2-ethyl-6-methyl-4-(octylcarbamoyl)-7-oxo-7-(propan-2-ylamino)heptanoic acid Traditional Name: 2-ethyl-7-(isopropylamino)-7-keto-6-methyl-4-(octylcarbamoyl)enanthic acid Formula: C22H42N2O4 MolecularWeight: 398.57988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C(CC(C)C(=O)NC(C)C)CC(CC)C(=O)O

Isomeric SMILES

CCCCCCCCNC(=O)C(CC(C)C(=O)NC(C)C)CC(CC)C(=O)O

InChI

InChI=1S/C22H42N2O4/c1-6-8-9-10-11-12-13-23-21(26)19(15-18(7-2)22(27)28)14-17(5)20(25)24-16(3)4/h16-19H,6-15H2,1-5H3,(H,23,26)(H,24,25)(H,27,28)