methyl (7E)-7-[(2R)-2-azanyl-2-octyl-5-oxidanylidene-cyclopent-3-en-1-ylidene]heptanoate

Systemtic Name: methyl (7E)-7-[(2R)-2-azanyl-2-octyl-5-oxidanylidene-cyclopent-3-en-1-ylidene]heptanoate Openeye Name: methyl (7E)-7-[(2R)-2-amino-2-octyl-5-oxo-cyclopent-3-en-1-ylidene]heptanoate CAS Name: (7E)-7-[(2R)-2-amino-2-octyl-5-oxo-1-cyclopent-3-enylidene]heptanoic acid methyl ester IUPAC Name: methyl (7E)-7-[(2R)-2-amino-2-octyl-5-oxocyclopent-3-en-1-ylidene]heptanoate Traditional Name: (7E)-7-[(2R)-2-amino-5-keto-2-octyl-cyclopent-3-en-1-ylidene]enanthic acid methyl ester Formula: C21H35NO3 MolecularWeight: 349.5075

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1(C=CC(=O)C1=CCCCCCC(=O)OC)N

Isomeric SMILES

CCCCCCCC[C@]\1(C=CC(=O)/C1=C/CCCCCC(=O)OC)N

InChI

InChI=1S/C21H35NO3/c1-3-4-5-6-9-12-16-21(22)17-15-19(23)18(21)13-10-7-8-11-14-20(24)25-2/h13,15,17H,3-12,14,16,22H2,1-2H3/b18-13-/t21-/m1/s1